1-[[2-amino-7-(1H-pyrazol-5-yl)quinolin-4-yl]amino]-2-methylpropan-2-ol;(2S)-1-[[2-amino-7-(1H-pyrazol-5-yl)quinolin-4-yl]amino]propan-2-ol;(2R)-1-[[2-amino-7-(1H-pyrazol-5-yl)quinolin-4-yl]amino]propan-2-ol;(2R)-1-[2-amino-7-(1H-pyrazol-5-yl)quinolin-4-yl]oxybutan-2-ol;4-N-butyl-6-fluoro-7-(1H-pyrazol-5-yl)quinoline-2,4-diamine;4-N-butyl-7-pyrazol-1-ylquinoline-2,4-diamine;cis-(1S,2R)-2-[[2-amino-7-(1H-pyrazol-5-yl)quinolin-4-yl]amino]cyclohexan-1-ol;cis-(1S,2R)-2-[[2-amino-7-(1H-pyrazol-5-yl)quinolin-4-yl]amino]cyclopentan-1-ol;4-N-(2,2-difluoro-2-pyridin-2-ylethyl)-7-(1H-pyrazol-5-yl)quinoline-2,4-diamine;4-[(3-ethyloxetan-3-yl)methoxy]-7-(1H-pyrazol-5-yl)quinolin-2-amine;4-N-[(1R,3R)-3-methylcyclopentyl]-7-(1H-pyrazol-5-yl)quinoline-2,4-diamine;4-N-[(1R,3S)-3-methylcyclopentyl]-7-(1H-pyrazol-5-yl)quinoline-2,4-diamine;4-N-[(1S,3S)-3-methylcyclopentyl]-7-(1H-pyrazol-5-yl)quinoline-2,4-diamine;4-N-(oxolan-3-yl)-7-(1H-pyrazol-5-yl)quinoline-2,4-diamine;7-(1H-pyrazol-5-yl)-4-(1H-pyrazol-5-ylmethoxy)quinolin-2-amine;7-(1H-pyrazol-5-yl)-4-N-(pyridin-2-ylmethyl)quinoline-2,4-diamine;7-(1H-pyrazol-5-yl)-4-N-(pyridin-3-ylmethyl)quinoline-2,4-diamine;7-(1H-pyrazol-5-yl)-4-N-[[(2R)-pyrrolidin-2-yl]methyl]quinoline-2,4-diamine;7-(1H-pyrazol-5-yl)-4-N-(1H-pyrrol-2-ylmethyl)quinoline-2,4-diamine

C322H346F3N99O11 — CID 167643998

IUPAC1-[[2-amino-7-(1H-pyrazol-5-yl)quinolin-4-yl]amino]-2-methylpropan-2-ol;(2S)-1-[[2-amino-7-(1H-pyrazol-5-yl)quinolin-4-yl]amino]propan-2-ol;(2R)-1-[[2-amino-7-(1H-pyrazol-5-yl)quinolin-4-yl]amino]propan-2-ol;(2R)-1-[2-amino-7-(1H-pyrazol-5-yl)quinolin-4-yl]oxybutan-2-ol;4-N-butyl-6-fluoro-7-(1H-pyrazol-5-yl)quinoline-2,4-diamine;4-N-butyl-7-pyrazol-1-ylquinoline-2,4-diamine;cis-(1S,2R)-2-[[2-amino-7-(1H-pyrazol-5-yl)quinolin-4-yl]amino]cyclohexan-1-ol;cis-(1S,2R)-2-[[2-amino-7-(1H-pyrazol-5-yl)quinolin-4-yl]amino]cyclopentan-1-ol;4-N-(2,2-difluoro-2-pyridin-2-ylethyl)-7-(1H-pyrazol-5-yl)quinoline-2,4-diamine;4-[(3-ethyloxetan-3-yl)methoxy]-7-(1H-pyrazol-5-yl)quinolin-2-amine;4-N-[(1R,3R)-3-methylcyclopentyl]-7-(1H-pyrazol-5-yl)quinoline-2,4-diamine;4-N-[(1R,3S)-3-methylcyclopentyl]-7-(1H-pyrazol-5-yl)quinoline-2,4-diamine;4-N-[(1S,3S)-3-methylcyclopentyl]-7-(1H-pyrazol-5-yl)quinoline-2,4-diamine;4-N-(oxolan-3-yl)-7-(1H-pyrazol-5-yl)quinoline-2,4-diamine;7-(1H-pyrazol-5-yl)-4-(1H-pyrazol-5-ylmethoxy)quinolin-2-amine;7-(1H-pyrazol-5-yl)-4-N-(pyridin-2-ylmethyl)quinoline-2,4-diamine;7-(1H-pyrazol-5-yl)-4-N-(pyridin-3-ylmethyl)quinoline-2,4-diamine;7-(1H-pyrazol-5-yl)-4-N-[[(2R)-pyrrolidin-2-yl]methyl]quinoline-2,4-diamine;7-(1H-pyrazol-5-yl)-4-N-(1H-pyrrol-2-ylmethyl)quinoline-2,4-diamine
SMILESCC(C)(O)CNc1cc(N)nc2cc(-c3ccn[nH]3)ccc12.CCC1(COc2cc(N)nc3cc(-c4ccn[nH]4)ccc23)COC1.CCCCNc1cc(N)nc2cc(-c3ccn[nH]3)c(F)cc12.CCCCNc1cc(N)nc2cc(-n3cccn3)ccc12.CC[C@@H](O)COc1cc(N)nc2cc(-c3ccn[nH]3)ccc12.C[C@@H](O)CNc1cc(N)nc2cc(-c3ccn[nH]3)ccc12.C[C@@H]1CC[C@@H](Nc2cc(N)nc3cc(-c4ccn[nH]4)ccc23)C1.C[C@H](O)CNc1cc(N)nc2cc(-c3ccn[nH]3)ccc12.C[C@H]1CC[C@@H](Nc2cc(N)nc3cc(-c4ccn[nH]4)ccc23)C1.C[C@H]1CC[C@H](Nc2cc(N)nc3cc(-c4ccn[nH]4)ccc23)C1.Nc1cc(NC2CCOC2)c2ccc(-c3ccn[nH]3)cc2n1.Nc1cc(NCC(F)(F)c2ccccn2)c2ccc(-c3ccn[nH]3)cc2n1.Nc1cc(NC[C@H]2CCCN2)c2ccc(-c3ccn[nH]3)cc2n1.Nc1cc(NCc2ccc[nH]2)c2ccc(-c3ccn[nH]3)cc2n1.Nc1cc(NCc2ccccn2)c2ccc(-c3ccn[nH]3)cc2n1.Nc1cc(NCc2cccnc2)c2ccc(-c3ccn[nH]3)cc2n1.Nc1cc(N[C@@H]2CCCC[C@@H]2O)c2ccc(-c3ccn[nH]3)cc2n1.Nc1cc(N[C@@H]2CCC[C@@H]2O)c2ccc(-c3ccn[nH]3)cc2n1.Nc1cc(OCc2ccn[nH]2)c2ccc(-c3ccn[nH]3)cc2n1
InChIInChI=1S/C19H16F2N6.2C18H16N6.C18H21N5O.3C18H21N5.C18H20N4O2.C17H20N6.C17H16N6.C17H19N5O.C16H18FN5.C16H14N6O.C16H17N5O.C16H19N5O.C16H19N5.C16H18N4O2.2C15H17N5O/c20-19(21,17-3-1-2-7-23-17)11-24-15-10-18(22)26-16-9-12(4-5-13(15)16)14-6-8-25-27-14;19-18-9-16(21-11-12-2-1-6-20-10-12)14-4-3-13(8-17(14)23-18)15-5-7-22-24-15;19-18-10-16(21-11-13-3-1-2-7-20-13)14-5-4-12(9-17(14)23-18)15-6-8-22-24-15;19-18-10-16(21-14-3-1-2-4-17(14)24)12-6-5-11(9-15(12)22-18)13-7-8-20-23-13;3*1-11-2-4-13(8-11)21-17-10-18(19)22-16-9-12(3-5-14(16)17)15-6-7-20-23-15;1-2-18(9-23-10-18)11-24-16-8-17(19)21-15-7-12(3-4-13(15)16)14-5-6-20-22-14;2*18-17-9-15(20-10-12-2-1-6-19-12)13-4-3-11(8-16(13)22-17)14-5-7-21-23-14;18-17-9-15(20-13-2-1-3-16(13)23)11-5-4-10(8-14(11)21-17)12-6-7-19-22-12;1-2-3-5-19-14-9-16(18)21-15-8-10(12(17)7-11(14)15)13-4-6-20-22-13;17-16-8-15(23-9-11-3-5-18-21-11)12-2-1-10(7-14(12)20-16)13-4-6-19-22-13;17-16-8-15(19-11-4-6-22-9-11)12-2-1-10(7-14(12)20-16)13-3-5-18-21-13;1-16(2,22)9-18-13-8-15(17)20-14-7-10(3-4-11(13)14)12-5-6-19-21-12;1-2-3-7-18-14-11-16(17)20-15-10-12(5-6-13(14)15)21-9-4-8-19-21;1-2-11(21)9-22-15-8-16(17)19-14-7-10(3-4-12(14)15)13-5-6-18-20-13;2*1-9(21)8-17-13-7-15(16)19-14-6-10(2-3-11(13)14)12-4-5-18-20-12/h1-10H,11H2,(H,25,27)(H3,22,24,26);2*1-10H,11H2,(H,22,24)(H3,19,21,23);5-10,14,17,24H,1-4H2,(H,20,23)(H3,19,21,22);3*3,5-7,9-11,13H,2,4,8H2,1H3,(H,20,23)(H3,19,21,22);3-8H,2,9-11H2,1H3,(H2,19,21)(H,20,22);3-5,7-9,12,19H,1-2,6,10H2,(H,21,23)(H3,18,20,22);1-9,19H,10H2,(H,21,23)(H3,18,20,22);4-9,13,16,23H,1-3H2,(H,19,22)(H3,18,20,21);4,6-9H,2-3,5H2,1H3,(H,20,22)(H3,18,19,21);1-8H,9H2,(H2,17,20)(H,18,21)(H,19,22);1-3,5,7-8,11H,4,6,9H2,(H,18,21)(H3,17,19,20);3-8,22H,9H2,1-2H3,(H,19,21)(H3,17,18,20);4-6,8-11H,2-3,7H2,1H3,(H3,17,18,20);3-8,11,21H,2,9H2,1H3,(H2,17,19)(H,18,20);2*2-7,9,21H,8H2,1H3,(H,18,20)(H3,16,17,19)/t;;;14-,17+;11-,13+;2*11-,13-;;12-;;13-,16+;;;;;;11-;2*9-/m...1010.1.1.....110/s1
InChIKeyPOSDSVKVXSGGEU-VZBZANHVSA-N
MW5835.99 g/mol
LogP56.08
Rot. Bonds75

About 1-[[2-amino-7-(1H-pyrazol-5-yl)quinolin-4-yl]amino]-2-methylpropan-2-ol;(2S)-1-[[2-amino-7-(1H-pyrazol-5-yl)quinolin-4-yl]amino]propan-2-ol;(2R)-1-[[2-amino-7-(1H-pyrazol-5-yl)quinolin-4-yl]amino]propan-2-ol;(2R)-1-[2-amino-7-(1H-pyrazol-5-yl)quinolin-4-yl]oxybutan-2-ol;4-N-butyl-6-fluoro-7-(1H-pyrazol-5-yl)quinoline-2,4-diamine;4-N-butyl-7-pyrazol-1-ylquinoline-2,4-diamine;cis-(1S,2R)-2-[[2-amino-7-(1H-pyrazol-5-yl)quinolin-4-yl]amino]cyclohexan-1-ol;cis-(1S,2R)-2-[[2-amino-7-(1H-pyrazol-5-yl)quinolin-4-yl]amino]cyclopentan-1-ol;4-N-(2,2-difluoro-2-pyridin-2-ylethyl)-7-(1H-pyrazol-5-yl)quinoline-2,4-diamine;4-[(3-ethyloxetan-3-yl)methoxy]-7-(1H-pyrazol-5-yl)quinolin-2-amine;4-N-[(1R,3R)-3-methylcyclopentyl]-7-(1H-pyrazol-5-yl)quinoline-2,4-diamine;4-N-[(1R,3S)-3-methylcyclopentyl]-7-(1H-pyrazol-5-yl)quinoline-2,4-diamine;4-N-[(1S,3S)-3-methylcyclopentyl]-7-(1H-pyrazol-5-yl)quinoline-2,4-diamine;4-N-(oxolan-3-yl)-7-(1H-pyrazol-5-yl)quinoline-2,4-diamine;7-(1H-pyrazol-5-yl)-4-(1H-pyrazol-5-ylmethoxy)quinolin-2-amine;7-(1H-pyrazol-5-yl)-4-N-(pyridin-2-ylmethyl)quinoline-2,4-diamine;7-(1H-pyrazol-5-yl)-4-N-(pyridin-3-ylmethyl)quinoline-2,4-diamine;7-(1H-pyrazol-5-yl)-4-N-[[(2R)-pyrrolidin-2-yl]methyl]quinoline-2,4-diamine;7-(1H-pyrazol-5-yl)-4-N-(1H-pyrrol-2-ylmethyl)quinoline-2,4-diamine

1-[[2-amino-7-(1H-pyrazol-5-yl)quinolin-4-yl]amino]-2-methylpropan-2-ol;(2S)-1-[[2-amino-7-(1H-pyrazol-5-yl)quinolin-4-yl]amino]propan-2-ol;(2R)-1-[[2-amino-7-(1H-pyrazol-5-yl)quinolin-4-yl]amino]propan-2-ol;(2R)-1-[2-amino-7-(1H-pyrazol-5-yl)quinolin-4-yl]oxybutan-2-ol;4-N-butyl-6-fluoro-7-(1H-pyrazol-5-yl)quinoline-2,4-diamine;4-N-butyl-7-pyrazol-1-ylquinoline-2,4-diamine;cis-(1S,2R)-2-[[2-amino-7-(1H-pyrazol-5-yl)quinolin-4-yl]amino]cyclohexan-1-ol;cis-(1S,2R)-2-[[2-amino-7-(1H-pyrazol-5-yl)quinolin-4-yl]amino]cyclopentan-1-ol;4-N-(2,2-difluoro-2-pyridin-2-ylethyl)-7-(1H-pyrazol-5-yl)quinoline-2,4-diamine;4-[(3-ethyloxetan-3-yl)methoxy]-7-(1H-pyrazol-5-yl)quinolin-2-amine;4-N-[(1R,3R)-3-methylcyclopentyl]-7-(1H-pyrazol-5-yl)quinoline-2,4-diamine;4-N-[(1R,3S)-3-methylcyclopentyl]-7-(1H-pyrazol-5-yl)quinoline-2,4-diamine;4-N-[(1S,3S)-3-methylcyclopentyl]-7-(1H-pyrazol-5-yl)quinoline-2,4-diamine;4-N-(oxolan-3-yl)-7-(1H-pyrazol-5-yl)quinoline-2,4-diamine;7-(1H-pyrazol-5-yl)-4-(1H-pyrazol-5-ylmethoxy)quinolin-2-amine;7-(1H-pyrazol-5-yl)-4-N-(pyridin-2-ylmethyl)quinoline-2,4-diamine;7-(1H-pyrazol-5-yl)-4-N-(pyridin-3-ylmethyl)quinoline-2,4-diamine;7-(1H-pyrazol-5-yl)-4-N-[[(2R)-pyrrolidin-2-yl]methyl]quinoline-2,4-diamine;7-(1H-pyrazol-5-yl)-4-N-(1H-pyrrol-2-ylmethyl)quinoline-2,4-diamine (PubChem CID 167643998) has the molecular formula C322H346F3N99O11 and a molecular weight of 5835.99 g/mol. Its IUPAC name is 1-[[2-amino-7-(1H-pyrazol-5-yl)quinolin-4-yl]amino]-2-methylpropan-2-ol;(2S)-1-[[2-amino-7-(1H-pyrazol-5-yl)quinolin-4-yl]amino]propan-2-ol;(2R)-1-[[2-amino-7-(1H-pyrazol-5-yl)quinolin-4-yl]amino]propan-2-ol;(2R)-1-[2-amino-7-(1H-pyrazol-5-yl)quinolin-4-yl]oxybutan-2-ol;4-N-butyl-6-fluoro-7-(1H-pyrazol-5-yl)quinoline-2,4-diamine;4-N-butyl-7-pyrazol-1-ylquinoline-2,4-diamine;cis-(1S,2R)-2-[[2-amino-7-(1H-pyrazol-5-yl)quinolin-4-yl]amino]cyclohexan-1-ol;cis-(1S,2R)-2-[[2-amino-7-(1H-pyrazol-5-yl)quinolin-4-yl]amino]cyclopentan-1-ol;4-N-(2,2-difluoro-2-pyridin-2-ylethyl)-7-(1H-pyrazol-5-yl)quinoline-2,4-diamine;4-[(3-ethyloxetan-3-yl)methoxy]-7-(1H-pyrazol-5-yl)quinolin-2-amine;4-N-[(1R,3R)-3-methylcyclopentyl]-7-(1H-pyrazol-5-yl)quinoline-2,4-diamine;4-N-[(1R,3S)-3-methylcyclopentyl]-7-(1H-pyrazol-5-yl)quinoline-2,4-diamine;4-N-[(1S,3S)-3-methylcyclopentyl]-7-(1H-pyrazol-5-yl)quinoline-2,4-diamine;4-N-(oxolan-3-yl)-7-(1H-pyrazol-5-yl)quinoline-2,4-diamine;7-(1H-pyrazol-5-yl)-4-(1H-pyrazol-5-ylmethoxy)quinolin-2-amine;7-(1H-pyrazol-5-yl)-4-N-(pyridin-2-ylmethyl)quinoline-2,4-diamine;7-(1H-pyrazol-5-yl)-4-N-(pyridin-3-ylmethyl)quinoline-2,4-diamine;7-(1H-pyrazol-5-yl)-4-N-[[(2R)-pyrrolidin-2-yl]methyl]quinoline-2,4-diamine;7-(1H-pyrazol-5-yl)-4-N-(1H-pyrrol-2-ylmethyl)quinoline-2,4-diamine.

Molecular Properties

Compound Name1-[[2-amino-7-(1H-pyrazol-5-yl)quinolin-4-yl]amino]-2-methylpropan-2-ol;(2S)-1-[[2-amino-7-(1H-pyrazol-5-yl)quinolin-4-yl]amino]propan-2-ol;(2R)-1-[[2-amino-7-(1H-pyrazol-5-yl)quinolin-4-yl]amino]propan-2-ol;(2R)-1-[2-amino-7-(1H-pyrazol-5-yl)quinolin-4-yl]oxybutan-2-ol;4-N-butyl-6-fluoro-7-(1H-pyrazol-5-yl)quinoline-2,4-diamine;4-N-butyl-7-pyrazol-1-ylquinoline-2,4-diamine;cis-(1S,2R)-2-[[2-amino-7-(1H-pyrazol-5-yl)quinolin-4-yl]amino]cyclohexan-1-ol;cis-(1S,2R)-2-[[2-amino-7-(1H-pyrazol-5-yl)quinolin-4-yl]amino]cyclopentan-1-ol;4-N-(2,2-difluoro-2-pyridin-2-ylethyl)-7-(1H-pyrazol-5-yl)quinoline-2,4-diamine;4-[(3-ethyloxetan-3-yl)methoxy]-7-(1H-pyrazol-5-yl)quinolin-2-amine;4-N-[(1R,3R)-3-methylcyclopentyl]-7-(1H-pyrazol-5-yl)quinoline-2,4-diamine;4-N-[(1R,3S)-3-methylcyclopentyl]-7-(1H-pyrazol-5-yl)quinoline-2,4-diamine;4-N-[(1S,3S)-3-methylcyclopentyl]-7-(1H-pyrazol-5-yl)quinoline-2,4-diamine;4-N-(oxolan-3-yl)-7-(1H-pyrazol-5-yl)quinoline-2,4-diamine;7-(1H-pyrazol-5-yl)-4-(1H-pyrazol-5-ylmethoxy)quinolin-2-amine;7-(1H-pyrazol-5-yl)-4-N-(pyridin-2-ylmethyl)quinoline-2,4-diamine;7-(1H-pyrazol-5-yl)-4-N-(pyridin-3-ylmethyl)quinoline-2,4-diamine;7-(1H-pyrazol-5-yl)-4-N-[[(2R)-pyrrolidin-2-yl]methyl]quinoline-2,4-diamine;7-(1H-pyrazol-5-yl)-4-N-(1H-pyrrol-2-ylmethyl)quinoline-2,4-diamine
PubChem CID167643998
Molecular FormulaC322H346F3N99O11
Molecular Weight5835.99 g/mol
Exact Mass5831.95
IUPAC Name1-[[2-amino-7-(1H-pyrazol-5-yl)quinolin-4-yl]amino]-2-methylpropan-2-ol;(2S)-1-[[2-amino-7-(1H-pyrazol-5-yl)quinolin-4-yl]amino]propan-2-ol;(2R)-1-[[2-amino-7-(1H-pyrazol-5-yl)quinolin-4-yl]amino]propan-2-ol;(2R)-1-[2-amino-7-(1H-pyrazol-5-yl)quinolin-4-yl]oxybutan-2-ol;4-N-butyl-6-fluoro-7-(1H-pyrazol-5-yl)quinoline-2,4-diamine;4-N-butyl-7-pyrazol-1-ylquinoline-2,4-diamine;cis-(1S,2R)-2-[[2-amino-7-(1H-pyrazol-5-yl)quinolin-4-yl]amino]cyclohexan-1-ol;cis-(1S,2R)-2-[[2-amino-7-(1H-pyrazol-5-yl)quinolin-4-yl]amino]cyclopentan-1-ol;4-N-(2,2-difluoro-2-pyridin-2-ylethyl)-7-(1H-pyrazol-5-yl)quinoline-2,4-diamine;4-[(3-ethyloxetan-3-yl)methoxy]-7-(1H-pyrazol-5-yl)quinolin-2-amine;4-N-[(1R,3R)-3-methylcyclopentyl]-7-(1H-pyrazol-5-yl)quinoline-2,4-diamine;4-N-[(1R,3S)-3-methylcyclopentyl]-7-(1H-pyrazol-5-yl)quinoline-2,4-diamine;4-N-[(1S,3S)-3-methylcyclopentyl]-7-(1H-pyrazol-5-yl)quinoline-2,4-diamine;4-N-(oxolan-3-yl)-7-(1H-pyrazol-5-yl)quinoline-2,4-diamine;7-(1H-pyrazol-5-yl)-4-(1H-pyrazol-5-ylmethoxy)quinolin-2-amine;7-(1H-pyrazol-5-yl)-4-N-(pyridin-2-ylmethyl)quinoline-2,4-diamine;7-(1H-pyrazol-5-yl)-4-N-(pyridin-3-ylmethyl)quinoline-2,4-diamine;7-(1H-pyrazol-5-yl)-4-N-[[(2R)-pyrrolidin-2-yl]methyl]quinoline-2,4-diamine;7-(1H-pyrazol-5-yl)-4-N-(1H-pyrrol-2-ylmethyl)quinoline-2,4-diamine
SMILESCC(C)(O)CNc1cc(N)nc2cc(-c3ccn[nH]3)ccc12.CCC1(COc2cc(N)nc3cc(-c4ccn[nH]4)ccc23)COC1.CCCCNc1cc(N)nc2cc(-c3ccn[nH]3)c(F)cc12.CCCCNc1cc(N)nc2cc(-n3cccn3)ccc12.CC[C@@H](O)COc1cc(N)nc2cc(-c3ccn[nH]3)ccc12.C[C@@H](O)CNc1cc(N)nc2cc(-c3ccn[nH]3)ccc12.C[C@@H]1CC[C@@H](Nc2cc(N)nc3cc(-c4ccn[nH]4)ccc23)C1.C[C@H](O)CNc1cc(N)nc2cc(-c3ccn[nH]3)ccc12.C[C@H]1CC[C@@H](Nc2cc(N)nc3cc(-c4ccn[nH]4)ccc23)C1.C[C@H]1CC[C@H](Nc2cc(N)nc3cc(-c4ccn[nH]4)ccc23)C1.Nc1cc(NC2CCOC2)c2ccc(-c3ccn[nH]3)cc2n1.Nc1cc(NCC(F)(F)c2ccccn2)c2ccc(-c3ccn[nH]3)cc2n1.Nc1cc(NC[C@H]2CCCN2)c2ccc(-c3ccn[nH]3)cc2n1.Nc1cc(NCc2ccc[nH]2)c2ccc(-c3ccn[nH]3)cc2n1.Nc1cc(NCc2ccccn2)c2ccc(-c3ccn[nH]3)cc2n1.Nc1cc(NCc2cccnc2)c2ccc(-c3ccn[nH]3)cc2n1.Nc1cc(N[C@@H]2CCCC[C@@H]2O)c2ccc(-c3ccn[nH]3)cc2n1.Nc1cc(N[C@@H]2CCC[C@@H]2O)c2ccc(-c3ccn[nH]3)cc2n1.Nc1cc(OCc2ccn[nH]2)c2ccc(-c3ccn[nH]3)cc2n1
InChIInChI=1S/C19H16F2N6.2C18H16N6.C18H21N5O.3C18H21N5.C18H20N4O2.C17H20N6.C17H16N6.C17H19N5O.C16H18FN5.C16H14N6O.C16H17N5O.C16H19N5O.C16H19N5.C16H18N4O2.2C15H17N5O/c20-19(21,17-3-1-2-7-23-17)11-24-15-10-18(22)26-16-9-12(4-5-13(15)16)14-6-8-25-27-14;19-18-9-16(21-11-12-2-1-6-20-10-12)14-4-3-13(8-17(14)23-18)15-5-7-22-24-15;19-18-10-16(21-11-13-3-1-2-7-20-13)14-5-4-12(9-17(14)23-18)15-6-8-22-24-15;19-18-10-16(21-14-3-1-2-4-17(14)24)12-6-5-11(9-15(12)22-18)13-7-8-20-23-13;3*1-11-2-4-13(8-11)21-17-10-18(19)22-16-9-12(3-5-14(16)17)15-6-7-20-23-15;1-2-18(9-23-10-18)11-24-16-8-17(19)21-15-7-12(3-4-13(15)16)14-5-6-20-22-14;2*18-17-9-15(20-10-12-2-1-6-19-12)13-4-3-11(8-16(13)22-17)14-5-7-21-23-14;18-17-9-15(20-13-2-1-3-16(13)23)11-5-4-10(8-14(11)21-17)12-6-7-19-22-12;1-2-3-5-19-14-9-16(18)21-15-8-10(12(17)7-11(14)15)13-4-6-20-22-13;17-16-8-15(23-9-11-3-5-18-21-11)12-2-1-10(7-14(12)20-16)13-4-6-19-22-13;17-16-8-15(19-11-4-6-22-9-11)12-2-1-10(7-14(12)20-16)13-3-5-18-21-13;1-16(2,22)9-18-13-8-15(17)20-14-7-10(3-4-11(13)14)12-5-6-19-21-12;1-2-3-7-18-14-11-16(17)20-15-10-12(5-6-13(14)15)21-9-4-8-19-21;1-2-11(21)9-22-15-8-16(17)19-14-7-10(3-4-12(14)15)13-5-6-18-20-13;2*1-9(21)8-17-13-7-15(16)19-14-6-10(2-3-11(13)14)12-4-5-18-20-12/h1-10H,11H2,(H,25,27)(H3,22,24,26);2*1-10H,11H2,(H,22,24)(H3,19,21,23);5-10,14,17,24H,1-4H2,(H,20,23)(H3,19,21,22);3*3,5-7,9-11,13H,2,4,8H2,1H3,(H,20,23)(H3,19,21,22);3-8H,2,9-11H2,1H3,(H2,19,21)(H,20,22);3-5,7-9,12,19H,1-2,6,10H2,(H,21,23)(H3,18,20,22);1-9,19H,10H2,(H,21,23)(H3,18,20,22);4-9,13,16,23H,1-3H2,(H,19,22)(H3,18,20,21);4,6-9H,2-3,5H2,1H3,(H,20,22)(H3,18,19,21);1-8H,9H2,(H2,17,20)(H,18,21)(H,19,22);1-3,5,7-8,11H,4,6,9H2,(H,18,21)(H3,17,19,20);3-8,22H,9H2,1-2H3,(H,19,21)(H3,17,18,20);4-6,8-11H,2-3,7H2,1H3,(H3,17,18,20);3-8,11,21H,2,9H2,1H3,(H2,17,19)(H,18,20);2*2-7,9,21H,8H2,1H3,(H,18,20)(H3,16,17,19)/t;;;14-,17+;11-,13+;2*11-,13-;;12-;;13-,16+;;;;;;11-;2*9-/m...1010.1.1.....110/s1
InChIKeyPOSDSVKVXSGGEU-VZBZANHVSA-N
XLogP56.08
TPSA1728.53 Ų
H-Bond Donors62
H-Bond Acceptors90
Rotatable Bonds75
Heavy Atoms435
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5005835.99
LogP ≤ 556.08
H-Bond Donors ≤ 562
H-Bond Acceptors ≤ 1090

Analyze 1-[[2-amino-7-(1H-pyrazol-5-yl)quinolin-4-yl]amino]-2-methylpropan-2-ol;(2S)-1-[[2-amino-7-(1H-pyrazol-5-yl)quinolin-4-yl]amino]propan-2-ol;(2R)-1-[[2-amino-7-(1H-pyrazol-5-yl)quinolin-4-yl]amino]propan-2-ol;(2R)-1-[2-amino-7-(1H-pyrazol-5-yl)quinolin-4-yl]oxybutan-2-ol;4-N-butyl-6-fluoro-7-(1H-pyrazol-5-yl)quinoline-2,4-diamine;4-N-butyl-7-pyrazol-1-ylquinoline-2,4-diamine;cis-(1S,2R)-2-[[2-amino-7-(1H-pyrazol-5-yl)quinolin-4-yl]amino]cyclohexan-1-ol;cis-(1S,2R)-2-[[2-amino-7-(1H-pyrazol-5-yl)quinolin-4-yl]amino]cyclopentan-1-ol;4-N-(2,2-difluoro-2-pyridin-2-ylethyl)-7-(1H-pyrazol-5-yl)quinoline-2,4-diamine;4-[(3-ethyloxetan-3-yl)methoxy]-7-(1H-pyrazol-5-yl)quinolin-2-amine;4-N-[(1R,3R)-3-methylcyclopentyl]-7-(1H-pyrazol-5-yl)quinoline-2,4-diamine;4-N-[(1R,3S)-3-methylcyclopentyl]-7-(1H-pyrazol-5-yl)quinoline-2,4-diamine;4-N-[(1S,3S)-3-methylcyclopentyl]-7-(1H-pyrazol-5-yl)quinoline-2,4-diamine;4-N-(oxolan-3-yl)-7-(1H-pyrazol-5-yl)quinoline-2,4-diamine;7-(1H-pyrazol-5-yl)-4-(1H-pyrazol-5-ylmethoxy)quinolin-2-amine;7-(1H-pyrazol-5-yl)-4-N-(pyridin-2-ylmethyl)quinoline-2,4-diamine;7-(1H-pyrazol-5-yl)-4-N-(pyridin-3-ylmethyl)quinoline-2,4-diamine;7-(1H-pyrazol-5-yl)-4-N-[[(2R)-pyrrolidin-2-yl]methyl]quinoline-2,4-diamine;7-(1H-pyrazol-5-yl)-4-N-(1H-pyrrol-2-ylmethyl)quinoline-2,4-diamine with MolForge

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Related Compounds

cis-(1S,2R)-2-[[2-amino-7-(2H-pyrrol-3-yl)quinolin-4-yl]amino]cyclohexan-1-ol;4-N-(2,2-difluoro-2-pyridin-2-ylethyl)-7-(2H-pyrrol-3-yl)quinoline-2,4-diamine;4-N-(oxolan-3-yl)-7-(2H-pyrrol-3-yl)quinoline-2,4-diamine;7-(1H-pyrazol-5-yl)-4-(1H-pyrazol-5-ylmethoxy)quinolin-2-amine;7-(1H-pyrazol-5-yl)-4-N-[[(2R)-pyrrolidin-2-yl]methyl]quinoline-2,4-diamine;4-N-(pyridin-3-ylmethyl)-7-(2H-pyrrol-3-yl)quinoline-2,4-diamine
CID 158180195
4-N-(2,2-difluoro-2-pyridin-2-ylethyl)-7-(2H-pyrrol-3-yl)quinoline-2,4-diamine;7-(1H-pyrazol-5-yl)-4-(1H-pyrazol-5-ylmethoxy)quinolin-2-amine;7-(1H-pyrazol-5-yl)-4-N-[[(2R)-pyrrolidin-2-yl]methyl]quinoline-2,4-diamine;4-N-(pyridin-2-ylmethyl)-7-(2H-pyrrol-3-yl)quinoline-2,4-diamine;4-N-(pyridin-3-ylmethyl)-7-(2H-pyrrol-3-yl)quinoline-2,4-diamine
CID 158860377
(2S)-1-[[2-amino-7-(2H-pyrrol-3-yl)quinolin-4-yl]amino]propan-2-ol;4-N-(2,2-difluoro-2-pyridin-2-ylethyl)-7-(2H-pyrrol-3-yl)quinoline-2,4-diamine;methane;7-(1H-pyrazol-5-yl)-4-(1H-pyrazol-5-ylmethoxy)quinolin-2-amine;7-(1H-pyrazol-5-yl)-4-N-[[(2R)-pyrrolidin-2-yl]methyl]quinoline-2,4-diamine;4-N-(pyridin-2-ylmethyl)-7-(2H-pyrrol-3-yl)quinoline-2,4-diamine;4-N-(pyridin-3-ylmethyl)-7-(2H-pyrrol-3-yl)quinoline-2,4-diamine
CID 165082117
(2R)-1-[[2-amino-7-(2H-pyrrol-3-yl)quinolin-4-yl]amino]propan-2-ol;(2S)-1-[[2-amino-7-(2H-pyrrol-3-yl)quinolin-4-yl]amino]propan-2-ol;4-N-butyl-7-pyrazol-1-ylquinoline-2,4-diamine;4-[(3-ethyloxetan-3-yl)methoxy]-7-(2H-pyrrol-3-yl)quinolin-2-amine;methane;4-N-[(1R,3R)-3-methylcyclopentyl]-7-(2H-pyrrol-3-yl)quinoline-2,4-diamine;4-N-[(1R,3S)-3-methylcyclopentyl]-7-(2H-pyrrol-3-yl)quinoline-2,4-diamine
CID 159709745
(2S)-1-[[2-amino-7-(2H-pyrrol-3-yl)quinolin-4-yl]amino]propan-2-ol;4-N-butyl-7-pyrazol-1-ylquinoline-2,4-diamine;cis-(1S,2R)-2-[[2-amino-7-(2H-pyrrol-3-yl)quinolin-4-yl]amino]cyclohexan-1-ol;4-[(3-ethyloxetan-3-yl)methoxy]-7-(2H-pyrrol-3-yl)quinolin-2-amine;4-N-(oxolan-3-yl)-7-(2H-pyrrol-3-yl)quinoline-2,4-diamine
CID 159871175
(2R)-1-[[2-amino-7-(2H-pyrrol-3-yl)quinolin-4-yl]amino]propan-2-ol;(2S)-1-[[2-amino-7-(2H-pyrrol-3-yl)quinolin-4-yl]amino]propan-2-ol;4-N-butyl-7-pyrazol-1-ylquinoline-2,4-diamine;4-[(3-ethyloxetan-3-yl)methoxy]-7-(2H-pyrrol-3-yl)quinolin-2-amine;4-N-[(1R,3R)-3-methylcyclopentyl]-7-(2H-pyrrol-3-yl)quinoline-2,4-diamine;4-N-[(1R,3S)-3-methylcyclopentyl]-7-(2H-pyrrol-3-yl)quinoline-2,4-diamine
CID 160690773
1-[[2-amino-7-(2H-pyrrol-3-yl)quinolin-4-yl]amino]-2-methylpropan-2-ol;(2R)-1-[2-amino-7-(2H-pyrrol-3-yl)quinolin-4-yl]oxybutan-2-ol;4-N-butyl-6-fluoro-7-(1H-pyrazol-5-yl)quinoline-2,4-diamine;4-N-[(1R,2S)-2-methylcyclopentyl]-7-(2H-pyrrol-3-yl)quinoline-2,4-diamine;4-N-[(1S,3S)-3-methylcyclopentyl]-7-(2H-pyrrol-3-yl)quinoline-2,4-diamine;7-(1H-pyrazol-5-yl)-4-N-(1H-pyrrol-2-ylmethyl)quinoline-2,4-diamine
CID 162142597
(2R)-1-[2-amino-7-(2H-pyrrol-3-yl)quinolin-4-yl]oxybutan-2-ol;4-N-butyl-6-fluoro-7-(1H-pyrazol-5-yl)quinoline-2,4-diamine;4-N-(2,2-dimethylpropyl)-7-(2H-pyrrol-3-yl)quinoline-2,4-diamine;4-N-[(1R,2S)-2-methylcyclopentyl]-7-(2H-pyrrol-3-yl)quinoline-2,4-diamine;4-N-[(1S,3S)-3-methylcyclopentyl]-7-(2H-pyrrol-3-yl)quinoline-2,4-diamine;7-(1H-pyrazol-5-yl)-4-N-(1H-pyrrol-2-ylmethyl)quinoline-2,4-diamine
CID 162208000
1-[[2-amino-7-(2H-pyrrol-3-yl)quinolin-4-yl]amino]-2-methylpropan-2-ol;(2R)-1-[[2-amino-7-(2H-pyrrol-3-yl)quinolin-4-yl]amino]propan-2-ol;(2R)-1-[2-amino-7-(2H-pyrrol-3-yl)quinolin-4-yl]oxybutan-2-ol;4-N-butyl-6-fluoro-7-(1H-pyrazol-5-yl)quinoline-2,4-diamine;4-N-butyl-7-pyrazol-1-ylquinoline-2,4-diamine;4-[(3-ethyloxetan-3-yl)methoxy]-7-(2H-pyrrol-3-yl)quinolin-2-amine;7-(1H-pyrazol-5-yl)-4-N-(1H-pyrrol-2-ylmethyl)quinoline-2,4-diamine
CID 164961854
1-[[2-amino-7-(2H-pyrrol-3-yl)quinolin-4-yl]amino]-2-methylpropan-2-ol;(2R)-1-[2-amino-7-(2H-pyrrol-3-yl)quinolin-4-yl]oxybutan-2-ol;(2R)-1-[2-amino-7-(2H-pyrrol-3-yl)quinolin-4-yl]oxypropan-2-ol;4-N-butyl-6-fluoro-7-(1H-pyrazol-5-yl)quinoline-2,4-diamine;4-N-butyl-7-pyrazol-1-ylquinoline-2,4-diamine;4-[(3-ethyloxetan-3-yl)methoxy]-7-(2H-pyrrol-3-yl)quinolin-2-amine;7-(1H-pyrazol-5-yl)-4-N-(1H-pyrrol-2-ylmethyl)quinoline-2,4-diamine
CID 165020192
1-[[2-amino-7-(2H-pyrrol-3-yl)quinolin-4-yl]amino]-2-methylpropan-2-ol;(2R)-1-[[2-amino-7-(2H-pyrrol-3-yl)quinolin-4-yl]amino]propan-2-ol;(2R)-1-[2-amino-7-(2H-pyrrol-3-yl)quinolin-4-yl]oxybutan-2-ol;4-N-butyl-6-fluoro-7-(1H-pyrazol-5-yl)quinoline-2,4-diamine;7-(1H-pyrazol-5-yl)-4-N-(1H-pyrrol-2-ylmethyl)quinoline-2,4-diamine
CID 165037646
1-[[2-amino-7-(1H-pyrazol-5-yl)quinolin-4-yl]amino]-2-methylpropan-2-ol;(2R)-1-[[2-amino-7-(1H-pyrazol-5-yl)quinolin-4-yl]amino]propan-2-ol;(2R)-1-[2-amino-7-(1H-pyrazol-5-yl)quinolin-4-yl]oxybutan-2-ol;4-N-butyl-6-fluoro-7-(1H-pyrazol-5-yl)quinoline-2,4-diamine;cis-(1S,2R)-2-[[2-amino-7-(1H-pyrazol-5-yl)quinolin-4-yl]amino]cyclopentan-1-ol;4-N-[(1S,3S)-3-methylcyclopentyl]-7-(1H-pyrazol-5-yl)quinoline-2,4-diamine;7-(1H-pyrazol-5-yl)-4-N-(1H-pyrrol-2-ylmethyl)quinoline-2,4-diamine
CID 167533259

Frequently Asked Questions

What is the IUPAC name of 1-[[2-amino-7-(1H-pyrazol-5-yl)quinolin-4-yl]amino]-2-methylpropan-2-ol;(2S)-1-[[2-amino-7-(1H-pyrazol-5-yl)quinolin-4-yl]amino]propan-2-ol;(2R)-1-[[2-amino-7-(1H-pyrazol-5-yl)quinolin-4-yl]amino]propan-2-ol;(2R)-1-[2-amino-7-(1H-pyrazol-5-yl)quinolin-4-yl]oxybutan-2-ol;4-N-butyl-6-fluoro-7-(1H-pyrazol-5-yl)quinoline-2,4-diamine;4-N-butyl-7-pyrazol-1-ylquinoline-2,4-diamine;cis-(1S,2R)-2-[[2-amino-7-(1H-pyrazol-5-yl)quinolin-4-yl]amino]cyclohexan-1-ol;cis-(1S,2R)-2-[[2-amino-7-(1H-pyrazol-5-yl)quinolin-4-yl]amino]cyclopentan-1-ol;4-N-(2,2-difluoro-2-pyridin-2-ylethyl)-7-(1H-pyrazol-5-yl)quinoline-2,4-diamine;4-[(3-ethyloxetan-3-yl)methoxy]-7-(1H-pyrazol-5-yl)quinolin-2-amine;4-N-[(1R,3R)-3-methylcyclopentyl]-7-(1H-pyrazol-5-yl)quinoline-2,4-diamine;4-N-[(1R,3S)-3-methylcyclopentyl]-7-(1H-pyrazol-5-yl)quinoline-2,4-diamine;4-N-[(1S,3S)-3-methylcyclopentyl]-7-(1H-pyrazol-5-yl)quinoline-2,4-diamine;4-N-(oxolan-3-yl)-7-(1H-pyrazol-5-yl)quinoline-2,4-diamine;7-(1H-pyrazol-5-yl)-4-(1H-pyrazol-5-ylmethoxy)quinolin-2-amine;7-(1H-pyrazol-5-yl)-4-N-(pyridin-2-ylmethyl)quinoline-2,4-diamine;7-(1H-pyrazol-5-yl)-4-N-(pyridin-3-ylmethyl)quinoline-2,4-diamine;7-(1H-pyrazol-5-yl)-4-N-[[(2R)-pyrrolidin-2-yl]methyl]quinoline-2,4-diamine;7-(1H-pyrazol-5-yl)-4-N-(1H-pyrrol-2-ylmethyl)quinoline-2,4-diamine?
The IUPAC name of 1-[[2-amino-7-(1H-pyrazol-5-yl)quinolin-4-yl]amino]-2-methylpropan-2-ol;(2S)-1-[[2-amino-7-(1H-pyrazol-5-yl)quinolin-4-yl]amino]propan-2-ol;(2R)-1-[[2-amino-7-(1H-pyrazol-5-yl)quinolin-4-yl]amino]propan-2-ol;(2R)-1-[2-amino-7-(1H-pyrazol-5-yl)quinolin-4-yl]oxybutan-2-ol;4-N-butyl-6-fluoro-7-(1H-pyrazol-5-yl)quinoline-2,4-diamine;4-N-butyl-7-pyrazol-1-ylquinoline-2,4-diamine;cis-(1S,2R)-2-[[2-amino-7-(1H-pyrazol-5-yl)quinolin-4-yl]amino]cyclohexan-1-ol;cis-(1S,2R)-2-[[2-amino-7-(1H-pyrazol-5-yl)quinolin-4-yl]amino]cyclopentan-1-ol;4-N-(2,2-difluoro-2-pyridin-2-ylethyl)-7-(1H-pyrazol-5-yl)quinoline-2,4-diamine;4-[(3-ethyloxetan-3-yl)methoxy]-7-(1H-pyrazol-5-yl)quinolin-2-amine;4-N-[(1R,3R)-3-methylcyclopentyl]-7-(1H-pyrazol-5-yl)quinoline-2,4-diamine;4-N-[(1R,3S)-3-methylcyclopentyl]-7-(1H-pyrazol-5-yl)quinoline-2,4-diamine;4-N-[(1S,3S)-3-methylcyclopentyl]-7-(1H-pyrazol-5-yl)quinoline-2,4-diamine;4-N-(oxolan-3-yl)-7-(1H-pyrazol-5-yl)quinoline-2,4-diamine;7-(1H-pyrazol-5-yl)-4-(1H-pyrazol-5-ylmethoxy)quinolin-2-amine;7-(1H-pyrazol-5-yl)-4-N-(pyridin-2-ylmethyl)quinoline-2,4-diamine;7-(1H-pyrazol-5-yl)-4-N-(pyridin-3-ylmethyl)quinoline-2,4-diamine;7-(1H-pyrazol-5-yl)-4-N-[[(2R)-pyrrolidin-2-yl]methyl]quinoline-2,4-diamine;7-(1H-pyrazol-5-yl)-4-N-(1H-pyrrol-2-ylmethyl)quinoline-2,4-diamine (CID 167643998) is 1-[[2-amino-7-(1H-pyrazol-5-yl)quinolin-4-yl]amino]-2-methylpropan-2-ol;(2S)-1-[[2-amino-7-(1H-pyrazol-5-yl)quinolin-4-yl]amino]propan-2-ol;(2R)-1-[[2-amino-7-(1H-pyrazol-5-yl)quinolin-4-yl]amino]propan-2-ol;(2R)-1-[2-amino-7-(1H-pyrazol-5-yl)quinolin-4-yl]oxybutan-2-ol;4-N-butyl-6-fluoro-7-(1H-pyrazol-5-yl)quinoline-2,4-diamine;4-N-butyl-7-pyrazol-1-ylquinoline-2,4-diamine;cis-(1S,2R)-2-[[2-amino-7-(1H-pyrazol-5-yl)quinolin-4-yl]amino]cyclohexan-1-ol;cis-(1S,2R)-2-[[2-amino-7-(1H-pyrazol-5-yl)quinolin-4-yl]amino]cyclopentan-1-ol;4-N-(2,2-difluoro-2-pyridin-2-ylethyl)-7-(1H-pyrazol-5-yl)quinoline-2,4-diamine;4-[(3-ethyloxetan-3-yl)methoxy]-7-(1H-pyrazol-5-yl)quinolin-2-amine;4-N-[(1R,3R)-3-methylcyclopentyl]-7-(1H-pyrazol-5-yl)quinoline-2,4-diamine;4-N-[(1R,3S)-3-methylcyclopentyl]-7-(1H-pyrazol-5-yl)quinoline-2,4-diamine;4-N-[(1S,3S)-3-methylcyclopentyl]-7-(1H-pyrazol-5-yl)quinoline-2,4-diamine;4-N-(oxolan-3-yl)-7-(1H-pyrazol-5-yl)quinoline-2,4-diamine;7-(1H-pyrazol-5-yl)-4-(1H-pyrazol-5-ylmethoxy)quinolin-2-amine;7-(1H-pyrazol-5-yl)-4-N-(pyridin-2-ylmethyl)quinoline-2,4-diamine;7-(1H-pyrazol-5-yl)-4-N-(pyridin-3-ylmethyl)quinoline-2,4-diamine;7-(1H-pyrazol-5-yl)-4-N-[[(2R)-pyrrolidin-2-yl]methyl]quinoline-2,4-diamine;7-(1H-pyrazol-5-yl)-4-N-(1H-pyrrol-2-ylmethyl)quinoline-2,4-diamine.
What is the SMILES notation for 1-[[2-amino-7-(1H-pyrazol-5-yl)quinolin-4-yl]amino]-2-methylpropan-2-ol;(2S)-1-[[2-amino-7-(1H-pyrazol-5-yl)quinolin-4-yl]amino]propan-2-ol;(2R)-1-[[2-amino-7-(1H-pyrazol-5-yl)quinolin-4-yl]amino]propan-2-ol;(2R)-1-[2-amino-7-(1H-pyrazol-5-yl)quinolin-4-yl]oxybutan-2-ol;4-N-butyl-6-fluoro-7-(1H-pyrazol-5-yl)quinoline-2,4-diamine;4-N-butyl-7-pyrazol-1-ylquinoline-2,4-diamine;cis-(1S,2R)-2-[[2-amino-7-(1H-pyrazol-5-yl)quinolin-4-yl]amino]cyclohexan-1-ol;cis-(1S,2R)-2-[[2-amino-7-(1H-pyrazol-5-yl)quinolin-4-yl]amino]cyclopentan-1-ol;4-N-(2,2-difluoro-2-pyridin-2-ylethyl)-7-(1H-pyrazol-5-yl)quinoline-2,4-diamine;4-[(3-ethyloxetan-3-yl)methoxy]-7-(1H-pyrazol-5-yl)quinolin-2-amine;4-N-[(1R,3R)-3-methylcyclopentyl]-7-(1H-pyrazol-5-yl)quinoline-2,4-diamine;4-N-[(1R,3S)-3-methylcyclopentyl]-7-(1H-pyrazol-5-yl)quinoline-2,4-diamine;4-N-[(1S,3S)-3-methylcyclopentyl]-7-(1H-pyrazol-5-yl)quinoline-2,4-diamine;4-N-(oxolan-3-yl)-7-(1H-pyrazol-5-yl)quinoline-2,4-diamine;7-(1H-pyrazol-5-yl)-4-(1H-pyrazol-5-ylmethoxy)quinolin-2-amine;7-(1H-pyrazol-5-yl)-4-N-(pyridin-2-ylmethyl)quinoline-2,4-diamine;7-(1H-pyrazol-5-yl)-4-N-(pyridin-3-ylmethyl)quinoline-2,4-diamine;7-(1H-pyrazol-5-yl)-4-N-[[(2R)-pyrrolidin-2-yl]methyl]quinoline-2,4-diamine;7-(1H-pyrazol-5-yl)-4-N-(1H-pyrrol-2-ylmethyl)quinoline-2,4-diamine?
The canonical SMILES for 1-[[2-amino-7-(1H-pyrazol-5-yl)quinolin-4-yl]amino]-2-methylpropan-2-ol;(2S)-1-[[2-amino-7-(1H-pyrazol-5-yl)quinolin-4-yl]amino]propan-2-ol;(2R)-1-[[2-amino-7-(1H-pyrazol-5-yl)quinolin-4-yl]amino]propan-2-ol;(2R)-1-[2-amino-7-(1H-pyrazol-5-yl)quinolin-4-yl]oxybutan-2-ol;4-N-butyl-6-fluoro-7-(1H-pyrazol-5-yl)quinoline-2,4-diamine;4-N-butyl-7-pyrazol-1-ylquinoline-2,4-diamine;cis-(1S,2R)-2-[[2-amino-7-(1H-pyrazol-5-yl)quinolin-4-yl]amino]cyclohexan-1-ol;cis-(1S,2R)-2-[[2-amino-7-(1H-pyrazol-5-yl)quinolin-4-yl]amino]cyclopentan-1-ol;4-N-(2,2-difluoro-2-pyridin-2-ylethyl)-7-(1H-pyrazol-5-yl)quinoline-2,4-diamine;4-[(3-ethyloxetan-3-yl)methoxy]-7-(1H-pyrazol-5-yl)quinolin-2-amine;4-N-[(1R,3R)-3-methylcyclopentyl]-7-(1H-pyrazol-5-yl)quinoline-2,4-diamine;4-N-[(1R,3S)-3-methylcyclopentyl]-7-(1H-pyrazol-5-yl)quinoline-2,4-diamine;4-N-[(1S,3S)-3-methylcyclopentyl]-7-(1H-pyrazol-5-yl)quinoline-2,4-diamine;4-N-(oxolan-3-yl)-7-(1H-pyrazol-5-yl)quinoline-2,4-diamine;7-(1H-pyrazol-5-yl)-4-(1H-pyrazol-5-ylmethoxy)quinolin-2-amine;7-(1H-pyrazol-5-yl)-4-N-(pyridin-2-ylmethyl)quinoline-2,4-diamine;7-(1H-pyrazol-5-yl)-4-N-(pyridin-3-ylmethyl)quinoline-2,4-diamine;7-(1H-pyrazol-5-yl)-4-N-[[(2R)-pyrrolidin-2-yl]methyl]quinoline-2,4-diamine;7-(1H-pyrazol-5-yl)-4-N-(1H-pyrrol-2-ylmethyl)quinoline-2,4-diamine is CC(C)(O)CNc1cc(N)nc2cc(-c3ccn[nH]3)ccc12.CCC1(COc2cc(N)nc3cc(-c4ccn[nH]4)ccc23)COC1.CCCCNc1cc(N)nc2cc(-c3ccn[nH]3)c(F)cc12.CCCCNc1cc(N)nc2cc(-n3cccn3)ccc12.CC[C@@H](O)COc1cc(N)nc2cc(-c3ccn[nH]3)ccc12.C[C@@H](O)CNc1cc(N)nc2cc(-c3ccn[nH]3)ccc12.C[C@@H]1CC[C@@H](Nc2cc(N)nc3cc(-c4ccn[nH]4)ccc23)C1.C[C@H](O)CNc1cc(N)nc2cc(-c3ccn[nH]3)ccc12.C[C@H]1CC[C@@H](Nc2cc(N)nc3cc(-c4ccn[nH]4)ccc23)C1.C[C@H]1CC[C@H](Nc2cc(N)nc3cc(-c4ccn[nH]4)ccc23)C1.Nc1cc(NC2CCOC2)c2ccc(-c3ccn[nH]3)cc2n1.Nc1cc(NCC(F)(F)c2ccccn2)c2ccc(-c3ccn[nH]3)cc2n1.Nc1cc(NC[C@H]2CCCN2)c2ccc(-c3ccn[nH]3)cc2n1.Nc1cc(NCc2ccc[nH]2)c2ccc(-c3ccn[nH]3)cc2n1.Nc1cc(NCc2ccccn2)c2ccc(-c3ccn[nH]3)cc2n1.Nc1cc(NCc2cccnc2)c2ccc(-c3ccn[nH]3)cc2n1.Nc1cc(N[C@@H]2CCCC[C@@H]2O)c2ccc(-c3ccn[nH]3)cc2n1.Nc1cc(N[C@@H]2CCC[C@@H]2O)c2ccc(-c3ccn[nH]3)cc2n1.Nc1cc(OCc2ccn[nH]2)c2ccc(-c3ccn[nH]3)cc2n1.
What is the InChIKey of 1-[[2-amino-7-(1H-pyrazol-5-yl)quinolin-4-yl]amino]-2-methylpropan-2-ol;(2S)-1-[[2-amino-7-(1H-pyrazol-5-yl)quinolin-4-yl]amino]propan-2-ol;(2R)-1-[[2-amino-7-(1H-pyrazol-5-yl)quinolin-4-yl]amino]propan-2-ol;(2R)-1-[2-amino-7-(1H-pyrazol-5-yl)quinolin-4-yl]oxybutan-2-ol;4-N-butyl-6-fluoro-7-(1H-pyrazol-5-yl)quinoline-2,4-diamine;4-N-butyl-7-pyrazol-1-ylquinoline-2,4-diamine;cis-(1S,2R)-2-[[2-amino-7-(1H-pyrazol-5-yl)quinolin-4-yl]amino]cyclohexan-1-ol;cis-(1S,2R)-2-[[2-amino-7-(1H-pyrazol-5-yl)quinolin-4-yl]amino]cyclopentan-1-ol;4-N-(2,2-difluoro-2-pyridin-2-ylethyl)-7-(1H-pyrazol-5-yl)quinoline-2,4-diamine;4-[(3-ethyloxetan-3-yl)methoxy]-7-(1H-pyrazol-5-yl)quinolin-2-amine;4-N-[(1R,3R)-3-methylcyclopentyl]-7-(1H-pyrazol-5-yl)quinoline-2,4-diamine;4-N-[(1R,3S)-3-methylcyclopentyl]-7-(1H-pyrazol-5-yl)quinoline-2,4-diamine;4-N-[(1S,3S)-3-methylcyclopentyl]-7-(1H-pyrazol-5-yl)quinoline-2,4-diamine;4-N-(oxolan-3-yl)-7-(1H-pyrazol-5-yl)quinoline-2,4-diamine;7-(1H-pyrazol-5-yl)-4-(1H-pyrazol-5-ylmethoxy)quinolin-2-amine;7-(1H-pyrazol-5-yl)-4-N-(pyridin-2-ylmethyl)quinoline-2,4-diamine;7-(1H-pyrazol-5-yl)-4-N-(pyridin-3-ylmethyl)quinoline-2,4-diamine;7-(1H-pyrazol-5-yl)-4-N-[[(2R)-pyrrolidin-2-yl]methyl]quinoline-2,4-diamine;7-(1H-pyrazol-5-yl)-4-N-(1H-pyrrol-2-ylmethyl)quinoline-2,4-diamine?
The InChIKey is POSDSVKVXSGGEU-VZBZANHVSA-N. The full InChI is InChI=1S/C19H16F2N6.2C18H16N6.C18H21N5O.3C18H21N5.C18H20N4O2.C17H20N6.C17H16N6.C17H19N5O.C16H18FN5.C16H14N6O.C16H17N5O.C16H19N5O.C16H19N5.C16H18N4O2.2C15H17N5O/c20-19(21,17-3-1-2-7-23-17)11-24-15-10-18(22)26-16-9-12(4-5-13(15)16)14-6-8-25-27-14;19-18-9-16(21-11-12-2-1-6-20-10-12)14-4-3-13(8-17(14)23-18)15-5-7-22-24-15;19-18-10-16(21-11-13-3-1-2-7-20-13)14-5-4-12(9-17(14)23-18)15-6-8-22-24-15;19-18-10-16(21-14-3-1-2-4-17(14)24)12-6-5-11(9-15(12)22-18)13-7-8-20-23-13;3*1-11-2-4-13(8-11)21-17-10-18(19)22-16-9-12(3-5-14(16)17)15-6-7-20-23-15;1-2-18(9-23-10-18)11-24-16-8-17(19)21-15-7-12(3-4-13(15)16)14-5-6-20-22-14;2*18-17-9-15(20-10-12-2-1-6-19-12)13-4-3-11(8-16(13)22-17)14-5-7-21-23-14;18-17-9-15(20-13-2-1-3-16(13)23)11-5-4-10(8-14(11)21-17)12-6-7-19-22-12;1-2-3-5-19-14-9-16(18)21-15-8-10(12(17)7-11(14)15)13-4-6-20-22-13;17-16-8-15(23-9-11-3-5-18-21-11)12-2-1-10(7-14(12)20-16)13-4-6-19-22-13;17-16-8-15(19-11-4-6-22-9-11)12-2-1-10(7-14(12)20-16)13-3-5-18-21-13;1-16(2,22)9-18-13-8-15(17)20-14-7-10(3-4-11(13)14)12-5-6-19-21-12;1-2-3-7-18-14-11-16(17)20-15-10-12(5-6-13(14)15)21-9-4-8-19-21;1-2-11(21)9-22-15-8-16(17)19-14-7-10(3-4-12(14)15)13-5-6-18-20-13;2*1-9(21)8-17-13-7-15(16)19-14-6-10(2-3-11(13)14)12-4-5-18-20-12/h1-10H,11H2,(H,25,27)(H3,22,24,26);2*1-10H,11H2,(H,22,24)(H3,19,21,23);5-10,14,17,24H,1-4H2,(H,20,23)(H3,19,21,22);3*3,5-7,9-11,13H,2,4,8H2,1H3,(H,20,23)(H3,19,21,22);3-8H,2,9-11H2,1H3,(H2,19,21)(H,20,22);3-5,7-9,12,19H,1-2,6,10H2,(H,21,23)(H3,18,20,22);1-9,19H,10H2,(H,21,23)(H3,18,20,22);4-9,13,16,23H,1-3H2,(H,19,22)(H3,18,20,21);4,6-9H,2-3,5H2,1H3,(H,20,22)(H3,18,19,21);1-8H,9H2,(H2,17,20)(H,18,21)(H,19,22);1-3,5,7-8,11H,4,6,9H2,(H,18,21)(H3,17,19,20);3-8,22H,9H2,1-2H3,(H,19,21)(H3,17,18,20);4-6,8-11H,2-3,7H2,1H3,(H3,17,18,20);3-8,11,21H,2,9H2,1H3,(H2,17,19)(H,18,20);2*2-7,9,21H,8H2,1H3,(H,18,20)(H3,16,17,19)/t;;;14-,17+;11-,13+;2*11-,13-;;12-;;13-,16+;;;;;;11-;2*9-/m...1010.1.1.....110/s1.
What are the key properties of 1-[[2-amino-7-(1H-pyrazol-5-yl)quinolin-4-yl]amino]-2-methylpropan-2-ol;(2S)-1-[[2-amino-7-(1H-pyrazol-5-yl)quinolin-4-yl]amino]propan-2-ol;(2R)-1-[[2-amino-7-(1H-pyrazol-5-yl)quinolin-4-yl]amino]propan-2-ol;(2R)-1-[2-amino-7-(1H-pyrazol-5-yl)quinolin-4-yl]oxybutan-2-ol;4-N-butyl-6-fluoro-7-(1H-pyrazol-5-yl)quinoline-2,4-diamine;4-N-butyl-7-pyrazol-1-ylquinoline-2,4-diamine;cis-(1S,2R)-2-[[2-amino-7-(1H-pyrazol-5-yl)quinolin-4-yl]amino]cyclohexan-1-ol;cis-(1S,2R)-2-[[2-amino-7-(1H-pyrazol-5-yl)quinolin-4-yl]amino]cyclopentan-1-ol;4-N-(2,2-difluoro-2-pyridin-2-ylethyl)-7-(1H-pyrazol-5-yl)quinoline-2,4-diamine;4-[(3-ethyloxetan-3-yl)methoxy]-7-(1H-pyrazol-5-yl)quinolin-2-amine;4-N-[(1R,3R)-3-methylcyclopentyl]-7-(1H-pyrazol-5-yl)quinoline-2,4-diamine;4-N-[(1R,3S)-3-methylcyclopentyl]-7-(1H-pyrazol-5-yl)quinoline-2,4-diamine;4-N-[(1S,3S)-3-methylcyclopentyl]-7-(1H-pyrazol-5-yl)quinoline-2,4-diamine;4-N-(oxolan-3-yl)-7-(1H-pyrazol-5-yl)quinoline-2,4-diamine;7-(1H-pyrazol-5-yl)-4-(1H-pyrazol-5-ylmethoxy)quinolin-2-amine;7-(1H-pyrazol-5-yl)-4-N-(pyridin-2-ylmethyl)quinoline-2,4-diamine;7-(1H-pyrazol-5-yl)-4-N-(pyridin-3-ylmethyl)quinoline-2,4-diamine;7-(1H-pyrazol-5-yl)-4-N-[[(2R)-pyrrolidin-2-yl]methyl]quinoline-2,4-diamine;7-(1H-pyrazol-5-yl)-4-N-(1H-pyrrol-2-ylmethyl)quinoline-2,4-diamine?
1-[[2-amino-7-(1H-pyrazol-5-yl)quinolin-4-yl]amino]-2-methylpropan-2-ol;(2S)-1-[[2-amino-7-(1H-pyrazol-5-yl)quinolin-4-yl]amino]propan-2-ol;(2R)-1-[[2-amino-7-(1H-pyrazol-5-yl)quinolin-4-yl]amino]propan-2-ol;(2R)-1-[2-amino-7-(1H-pyrazol-5-yl)quinolin-4-yl]oxybutan-2-ol;4-N-butyl-6-fluoro-7-(1H-pyrazol-5-yl)quinoline-2,4-diamine;4-N-butyl-7-pyrazol-1-ylquinoline-2,4-diamine;cis-(1S,2R)-2-[[2-amino-7-(1H-pyrazol-5-yl)quinolin-4-yl]amino]cyclohexan-1-ol;cis-(1S,2R)-2-[[2-amino-7-(1H-pyrazol-5-yl)quinolin-4-yl]amino]cyclopentan-1-ol;4-N-(2,2-difluoro-2-pyridin-2-ylethyl)-7-(1H-pyrazol-5-yl)quinoline-2,4-diamine;4-[(3-ethyloxetan-3-yl)methoxy]-7-(1H-pyrazol-5-yl)quinolin-2-amine;4-N-[(1R,3R)-3-methylcyclopentyl]-7-(1H-pyrazol-5-yl)quinoline-2,4-diamine;4-N-[(1R,3S)-3-methylcyclopentyl]-7-(1H-pyrazol-5-yl)quinoline-2,4-diamine;4-N-[(1S,3S)-3-methylcyclopentyl]-7-(1H-pyrazol-5-yl)quinoline-2,4-diamine;4-N-(oxolan-3-yl)-7-(1H-pyrazol-5-yl)quinoline-2,4-diamine;7-(1H-pyrazol-5-yl)-4-(1H-pyrazol-5-ylmethoxy)quinolin-2-amine;7-(1H-pyrazol-5-yl)-4-N-(pyridin-2-ylmethyl)quinoline-2,4-diamine;7-(1H-pyrazol-5-yl)-4-N-(pyridin-3-ylmethyl)quinoline-2,4-diamine;7-(1H-pyrazol-5-yl)-4-N-[[(2R)-pyrrolidin-2-yl]methyl]quinoline-2,4-diamine;7-(1H-pyrazol-5-yl)-4-N-(1H-pyrrol-2-ylmethyl)quinoline-2,4-diamine has a molecular weight of 5835.99 g/mol, XLogP of 56.08, 75 rotatable bonds, 62 hydrogen bond donors, and 90 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[[2-amino-7-(1H-pyrazol-5-yl)quinolin-4-yl]amino]-2-methylpropan-2-ol;(2S)-1-[[2-amino-7-(1H-pyrazol-5-yl)quinolin-4-yl]amino]propan-2-ol;(2R)-1-[[2-amino-7-(1H-pyrazol-5-yl)quinolin-4-yl]amino]propan-2-ol;(2R)-1-[2-amino-7-(1H-pyrazol-5-yl)quinolin-4-yl]oxybutan-2-ol;4-N-butyl-6-fluoro-7-(1H-pyrazol-5-yl)quinoline-2,4-diamine;4-N-butyl-7-pyrazol-1-ylquinoline-2,4-diamine;cis-(1S,2R)-2-[[2-amino-7-(1H-pyrazol-5-yl)quinolin-4-yl]amino]cyclohexan-1-ol;cis-(1S,2R)-2-[[2-amino-7-(1H-pyrazol-5-yl)quinolin-4-yl]amino]cyclopentan-1-ol;4-N-(2,2-difluoro-2-pyridin-2-ylethyl)-7-(1H-pyrazol-5-yl)quinoline-2,4-diamine;4-[(3-ethyloxetan-3-yl)methoxy]-7-(1H-pyrazol-5-yl)quinolin-2-amine;4-N-[(1R,3R)-3-methylcyclopentyl]-7-(1H-pyrazol-5-yl)quinoline-2,4-diamine;4-N-[(1R,3S)-3-methylcyclopentyl]-7-(1H-pyrazol-5-yl)quinoline-2,4-diamine;4-N-[(1S,3S)-3-methylcyclopentyl]-7-(1H-pyrazol-5-yl)quinoline-2,4-diamine;4-N-(oxolan-3-yl)-7-(1H-pyrazol-5-yl)quinoline-2,4-diamine;7-(1H-pyrazol-5-yl)-4-(1H-pyrazol-5-ylmethoxy)quinolin-2-amine;7-(1H-pyrazol-5-yl)-4-N-(pyridin-2-ylmethyl)quinoline-2,4-diamine;7-(1H-pyrazol-5-yl)-4-N-(pyridin-3-ylmethyl)quinoline-2,4-diamine;7-(1H-pyrazol-5-yl)-4-N-[[(2R)-pyrrolidin-2-yl]methyl]quinoline-2,4-diamine;7-(1H-pyrazol-5-yl)-4-N-(1H-pyrrol-2-ylmethyl)quinoline-2,4-diamine is sourced from PubChem (CID 167643998), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).