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

C91H85F2N27O — CID 158860377

IUPAC4-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
SMILESNc1cc(NCC(F)(F)c2ccccn2)c2ccc(C3=CC=NC3)cc2n1.Nc1cc(NC[C@H]2CCCN2)c2ccc(-c3ccn[nH]3)cc2n1.Nc1cc(NCc2ccccn2)c2ccc(C3=CC=NC3)cc2n1.Nc1cc(NCc2cccnc2)c2ccc(C3=CC=NC3)cc2n1.Nc1cc(OCc2ccn[nH]2)c2ccc(-c3ccn[nH]3)cc2n1
InChIInChI=1S/C20H17F2N5.2C19H17N5.C17H20N6.C16H14N6O/c21-20(22,18-3-1-2-7-25-18)12-26-16-10-19(23)27-17-9-13(4-5-15(16)17)14-6-8-24-11-14;20-19-9-17(23-11-13-2-1-6-21-10-13)16-4-3-14(8-18(16)24-19)15-5-7-22-12-15;20-19-10-17(23-12-15-3-1-2-7-22-15)16-5-4-13(9-18(16)24-19)14-6-8-21-11-14;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;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/h1-10H,11-12H2,(H3,23,26,27);2*1-10H,11-12H2,(H3,20,23,24);3-5,7-9,12,19H,1-2,6,10H2,(H,21,23)(H3,18,20,22);1-8H,9H2,(H2,17,20)(H,18,21)(H,19,22)/t;;;12-;/m...1./s1
InChIKeyJAOQMAQRZDUDOB-AHHMKHIISA-N
MW1610.86 g/mol
LogP15.35
Rot. Bonds21

About 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

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 (PubChem CID 158860377) has the molecular formula C91H85F2N27O and a molecular weight of 1610.86 g/mol. Its IUPAC name is 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.

Molecular Properties

Compound Name4-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
PubChem CID158860377
Molecular FormulaC91H85F2N27O
Molecular Weight1610.86 g/mol
Exact Mass1609.74
IUPAC Name4-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
SMILESNc1cc(NCC(F)(F)c2ccccn2)c2ccc(C3=CC=NC3)cc2n1.Nc1cc(NC[C@H]2CCCN2)c2ccc(-c3ccn[nH]3)cc2n1.Nc1cc(NCc2ccccn2)c2ccc(C3=CC=NC3)cc2n1.Nc1cc(NCc2cccnc2)c2ccc(C3=CC=NC3)cc2n1.Nc1cc(OCc2ccn[nH]2)c2ccc(-c3ccn[nH]3)cc2n1
InChIInChI=1S/C20H17F2N5.2C19H17N5.C17H20N6.C16H14N6O/c21-20(22,18-3-1-2-7-25-18)12-26-16-10-19(23)27-17-9-13(4-5-15(16)17)14-6-8-24-11-14;20-19-9-17(23-11-13-2-1-6-21-10-13)16-4-3-14(8-18(16)24-19)15-5-7-22-12-15;20-19-10-17(23-12-15-3-1-2-7-22-15)16-5-4-13(9-18(16)24-19)14-6-8-21-11-14;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;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/h1-10H,11-12H2,(H3,23,26,27);2*1-10H,11-12H2,(H3,20,23,24);3-5,7-9,12,19H,1-2,6,10H2,(H,21,23)(H3,18,20,22);1-8H,9H2,(H2,17,20)(H,18,21)(H,19,22)/t;;;12-;/m...1./s1
InChIKeyJAOQMAQRZDUDOB-AHHMKHIISA-N
XLogP15.35
TPSA425.72 Ų
H-Bond Donors13
H-Bond Acceptors25
Rotatable Bonds21
Heavy Atoms121
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5001610.86
LogP ≤ 515.35
H-Bond Donors ≤ 513
H-Bond Acceptors ≤ 1025

Analyze 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 with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

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
2-(2,4-difluorophenyl)-4-methyl-6-(5-methyl-1H-pyrazol-3-yl)pyridine;2-(2-ethoxy-4-fluorophenyl)-4-methyl-6-(5-methyl-1H-pyrazol-3-yl)pyridine;2-(4-methylphenyl)-6-(5-methyl-1H-pyrazol-3-yl)pyridine;2-(4-methylphenyl)-6-(5-methyl-1H-pyrazol-3-yl)-4-(trifluoromethyl)pyridine;1-(5-methyl-1H-pyrazol-3-yl)-3-phenylisoquinoline;5-[6-(5-methyl-1H-pyrazol-3-yl)-2-pyridinyl]-2-(trifluoromethyl)pyrimidine;2-(5-methyl-1H-pyrazol-3-yl)-6-[4-(trifluoromethyl)phenyl]pyridine;2-(5-methyl-1H-pyrazol-3-yl)-4-(trifluoromethyl)-6-[4-(trifluoromethyl)phenyl]pyridine
CID 158601779
N-[4-(2-aminoethoxy)-6-[2-(trifluoromethyl)phenyl]-2-pyridinyl]-1H-indazol-3-amine;4-N-(2-aminoethyl)-2-N-(1H-indazol-3-yl)-6-[2-(trifluoromethyl)phenyl]pyridine-2,4-diamine;N-[6-(2-chlorophenyl)-4-pyridin-4-yl-2-pyridinyl]-1H-indazol-3-amine;N-[4-piperazin-1-yl-6-[2-(trifluoromethyl)phenyl]-2-pyridinyl]-1H-indazol-3-amine
CID 159662450
N-(5-amino-2-pyridinyl)-4-[7-(trifluoromethyl)-3,4-dihydro-2H-chromen-4-yl]piperazine-1-carboxamide;N-(2-ethylpyrazol-3-yl)-4-[7-(trifluoromethyl)-3,4-dihydro-2H-chromen-4-yl]piperazine-1-carboxamide;N-[6-(methylamino)-3-pyridinyl]-4-[7-(trifluoromethyl)-3,4-dihydro-2H-chromen-4-yl]piperazine-1-carboxamide;N-(2-methylpyrazol-3-yl)-4-[7-(trifluoromethyl)-3,4-dihydro-2H-chromen-4-yl]piperazine-1-carboxamide;N-(5-methyl-1H-pyrazol-3-yl)-4-[7-(trifluoromethyl)-3,4-dihydro-2H-chromen-4-yl]piperazine-1-carboxamide;N-(1H-pyrazol-5-yl)-4-[7-(trifluoromethyl)-3,4-dihydro-2H-chromen-4-yl]piperazine-1-carboxamide
CID 159721327
4-[4-(cyclohexylamino)-1H-pyrrolo[3,4-c]pyridin-3-yl]benzonitrile;N-cyclohexyl-3-(2,3-difluorophenyl)-1H-pyrrolo[3,4-c]pyridin-4-amine;N-cyclohexyl-3-(4-methyl-2,3-dihydro-1,4-benzoxazin-7-yl)-1H-pyrazolo[4,3-c]pyridin-4-amine;N-cyclohexyl-3-(1-methylpyrazol-4-yl)-1H-pyrazolo[4,3-c]pyridin-4-amine;N-cyclohexyl-3-(2-morpholin-4-ylpyrimidin-5-yl)-1H-pyrazolo[4,3-c]pyridin-4-amine;N-cyclohexyl-3-[4-(trifluoromethyl)phenyl]-1H-pyrrolo[3,4-c]pyridin-4-amine
CID 160483666
4-(4-Methoxy-3-pyridinyl)-12-[4-(piperidin-1-ylmethyl)phenyl]-5,8,10-triazatricyclo[7.4.0.02,7]trideca-1(9),2,4,6,10,12-hexaene;4-(5-methoxy-3-pyridinyl)-12-[4-(piperidin-1-ylmethyl)phenyl]-5,8,10-triazatricyclo[7.4.0.02,7]trideca-1(9),2,4,6,10,12-hexaene;12-(1-methylpyrazol-4-yl)-4-(4-piperidin-4-yloxy-3-pyridinyl)-5,8,10-triazatricyclo[7.4.0.02,7]trideca-1(9),2,4,6,10,12-hexaene;12-[4-(piperidin-1-ylmethyl)phenyl]-4-pyridin-3-yl-5,8,10-triazatricyclo[7.4.0.02,7]trideca-1(9),2,4,6,10,12-hexaene;12-[4-(piperidin-1-ylmethyl)phenyl]-4-pyridin-4-yl-5,8,10-triazatricyclo[7.4.0.02,7]trideca-1(9),2,4,6,10,12-hexaene;4-pyridin-3-yl-12-[4-[[4-(trifluoromethyl)piperidin-1-yl]methyl]phenyl]-5,8,10-triazatricyclo[7.4.0.02,7]trideca-1(9),2,4,6,10,12-hexaene
CID 161555518
1-[4-[(3-fluoro-4-methyl-2-pyridinyl)oxy]cyclohexyl]-N-methyl-3-(1-methylpyrazol-3-yl)pyrazolo[4,3-c]pyridin-6-amine;1-[4-[(3-fluoro-4-methyl-2-pyridinyl)oxy]cyclohexyl]-3-(1-methylpyrazol-4-yl)-N-phenylpyrazolo[4,3-c]pyridin-6-amine;3-(1-methylpyrazol-4-yl)-1-[4-[1-methyl-3-(trifluoromethyl)pyrazol-4-yl]oxycyclohexyl]-N-phenylpyrazolo[4,3-c]pyridin-6-amine;3-(1-methylpyrazol-4-yl)-N-phenyl-1-[4-[[2-(trifluoromethyl)-3-pyridinyl]oxy]cyclohexyl]pyrazolo[4,3-c]pyridin-6-amine;3-(1-methylpyrazol-4-yl)-N-phenyl-1-[4-[[3-(trifluoromethyl)-2-pyridinyl]oxy]cyclohexyl]pyrazolo[4,3-c]pyridin-6-amine
CID 163728675
[5-[4-[6-(ethylamino)-3-(1-methylpyrazol-4-yl)pyrazolo[4,3-c]pyridin-1-yl]cyclohexyl]oxy-1-methylpyrazol-3-yl]methanol;N-ethyl-1-[4-[(3-fluoro-4-methyl-2-pyridinyl)oxy]cyclohexyl]-3-(1-methylpiperidin-4-yl)pyrazolo[4,3-c]pyridin-6-amine;N-ethyl-1-[4-[(3-fluoro-4-methyl-2-pyridinyl)oxy]cyclohexyl]-3-(oxan-4-yl)pyrazolo[4,3-c]pyridin-6-amine;N-ethyl-1-[4-[(3-fluoro-4-methyl-2-pyridinyl)oxy]cyclohexyl]-3-propan-2-ylpyrazolo[4,3-c]pyridin-6-amine;N-ethyl-3-(1-methylpiperidin-4-yl)-1-[4-[[5-(trifluoromethyl)-1H-pyrazol-4-yl]oxy]cyclohexyl]pyrazolo[4,3-c]pyridin-6-amine
CID 163763222
N-methyl-3-(1-methylpyrazol-4-yl)-1-[4-[(2-methyl-3-pyridinyl)oxy]cyclohexyl]pyrazolo[4,3-c]pyridin-6-amine;N-methyl-3-(1-methylpyrazol-4-yl)-1-[4-[(4-methyl-3-pyridinyl)oxy]cyclohexyl]pyrazolo[4,3-c]pyridin-6-amine;N-methyl-3-(1-methylpyrazol-4-yl)-1-[4-[(5-methyl-3-pyridinyl)oxy]cyclohexyl]pyrazolo[4,3-c]pyridin-6-amine;N-methyl-3-(1-methylpyrazol-4-yl)-1-(4-pyridin-2-yloxycyclohexyl)pyrazolo[4,3-c]pyridin-6-amine;N-methyl-3-(1-methylpyrazol-4-yl)-1-(4-pyridin-3-yloxycyclohexyl)pyrazolo[4,3-c]pyridin-6-amine;N-methyl-3-(1-methylpyrazol-4-yl)-1-[4-[[2-(trifluoromethyl)-3-pyridinyl]oxy]cyclohexyl]pyrazolo[4,3-c]pyridin-6-amine
CID 163916946
(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
7-[5-amino-6-(1-ethylpyrazol-4-yl)oxypyrazin-2-yl]-N,2-dimethyl-3,4-dihydro-1H-isoquinolin-5-amine;3-[(2-amino-4-pyridinyl)methoxy]-5-[2-methyl-5-(trifluoromethyl)-3,4-dihydro-1H-isoquinolin-7-yl]pyrazin-2-amine;3-[1-(cyclopropylmethyl)pyrazol-4-yl]oxy-5-(2,5-dimethyl-3,4-dihydro-1H-isoquinolin-7-yl)pyrazin-2-amine;5-(2,5-dimethyl-3,4-dihydro-1H-isoquinolin-7-yl)-3-(1-propan-2-ylpyrazol-4-yl)oxypyrazin-2-amine;3-(1-ethylpyrazol-4-yl)oxy-5-(5-methoxy-2-methyl-3,4-dihydro-1H-isoquinolin-7-yl)pyrazin-2-amine
CID 167623280
CID 167643998
CID 167643998

Frequently Asked Questions

What is the IUPAC name of 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?
The IUPAC name of 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) is 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.
What is the SMILES notation for 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?
The canonical SMILES for 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 is Nc1cc(NCC(F)(F)c2ccccn2)c2ccc(C3=CC=NC3)cc2n1.Nc1cc(NC[C@H]2CCCN2)c2ccc(-c3ccn[nH]3)cc2n1.Nc1cc(NCc2ccccn2)c2ccc(C3=CC=NC3)cc2n1.Nc1cc(NCc2cccnc2)c2ccc(C3=CC=NC3)cc2n1.Nc1cc(OCc2ccn[nH]2)c2ccc(-c3ccn[nH]3)cc2n1.
What is the InChIKey of 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?
The InChIKey is JAOQMAQRZDUDOB-AHHMKHIISA-N. The full InChI is InChI=1S/C20H17F2N5.2C19H17N5.C17H20N6.C16H14N6O/c21-20(22,18-3-1-2-7-25-18)12-26-16-10-19(23)27-17-9-13(4-5-15(16)17)14-6-8-24-11-14;20-19-9-17(23-11-13-2-1-6-21-10-13)16-4-3-14(8-18(16)24-19)15-5-7-22-12-15;20-19-10-17(23-12-15-3-1-2-7-22-15)16-5-4-13(9-18(16)24-19)14-6-8-21-11-14;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;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/h1-10H,11-12H2,(H3,23,26,27);2*1-10H,11-12H2,(H3,20,23,24);3-5,7-9,12,19H,1-2,6,10H2,(H,21,23)(H3,18,20,22);1-8H,9H2,(H2,17,20)(H,18,21)(H,19,22)/t;;;12-;/m...1./s1.
What are the key properties of 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?
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 has a molecular weight of 1610.86 g/mol, XLogP of 15.35, 21 rotatable bonds, 13 hydrogen bond donors, and 25 hydrogen bond acceptors.
Where does this data come from?
All data for 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 is sourced from PubChem (CID 158860377), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).