7-ethyl-N-propan-2-ylpyrido[3,4-b]pyrazin-3-amine;2-ethyl-N-propan-2-yl-[1,3]thiazolo[4,5-b]pyridin-6-amine;7-methoxy-N-propan-2-ylpyrido[3,4-b]pyrazin-3-amine;5-methyl-7-(propan-2-ylamino)pyrido[2,3-b]pyrazin-6-one;N-methyl-N-propan-2-ylpyrido[2,3-b]pyrazin-2-amine;2-methyl-N-propan-2-ylpyrido[3,2-d]pyrimidin-7-amine;2-(propan-2-ylamino)-4H-pyrido[2,3-b]pyrazin-3-one;7-(propan-2-ylamino)-5H-pyrido[3,2-d]pyrimidin-6-one;7-(propan-2-ylamino)-2-(trifluoromethyl)-5H-pyrido[3,2-d]pyrimidin-6-one;N-propan-2-ylpyrazino[2,3-c]pyridazin-3-amine;N-propan-2-ylpyrido[2,3-b]pyrazin-7-amine;N-propan-2-ylpyrimido[4,5-d]pyrimidin-2-amine;N-propan-2-yl-5,6,7,8-tetrahydro-1,2,4-benzotriazin-3-amine;N-propan-2-yl-[1,3]thiazolo[4,5-b]pyridin-6-amine;N-propan-2-yl-6-(trifluoromethyl)pyrido[2,3-c]pyridazin-3-amine;N-propan-2-yl-7-(trifluoromethyl)pyrimido[4,5-d]pyrimidin-2-amine;N-(2-pyrazino[2,3-c]pyridazin-3-ylethyl)propan-2-amine;N-[[2-(trifluoromethyl)pyrimido[4,5-d]pyrimidin-7-yl]methyl]propan-2-amine

C188H231F12N75O5S2 — CID 159433350

IUPAC7-ethyl-N-propan-2-ylpyrido[3,4-b]pyrazin-3-amine;2-ethyl-N-propan-2-yl-[1,3]thiazolo[4,5-b]pyridin-6-amine;7-methoxy-N-propan-2-ylpyrido[3,4-b]pyrazin-3-amine;5-methyl-7-(propan-2-ylamino)pyrido[2,3-b]pyrazin-6-one;N-methyl-N-propan-2-ylpyrido[2,3-b]pyrazin-2-amine;2-methyl-N-propan-2-ylpyrido[3,2-d]pyrimidin-7-amine;2-(propan-2-ylamino)-4H-pyrido[2,3-b]pyrazin-3-one;7-(propan-2-ylamino)-5H-pyrido[3,2-d]pyrimidin-6-one;7-(propan-2-ylamino)-2-(trifluoromethyl)-5H-pyrido[3,2-d]pyrimidin-6-one;N-propan-2-ylpyrazino[2,3-c]pyridazin-3-amine;N-propan-2-ylpyrido[2,3-b]pyrazin-7-amine;N-propan-2-ylpyrimido[4,5-d]pyrimidin-2-amine;N-propan-2-yl-5,6,7,8-tetrahydro-1,2,4-benzotriazin-3-amine;N-propan-2-yl-[1,3]thiazolo[4,5-b]pyridin-6-amine;N-propan-2-yl-6-(trifluoromethyl)pyrido[2,3-c]pyridazin-3-amine;N-propan-2-yl-7-(trifluoromethyl)pyrimido[4,5-d]pyrimidin-2-amine;N-(2-pyrazino[2,3-c]pyridazin-3-ylethyl)propan-2-amine;N-[[2-(trifluoromethyl)pyrimido[4,5-d]pyrimidin-7-yl]methyl]propan-2-amine
SMILESCC(C)N(C)c1cnc2ncccc2n1.CC(C)NCCc1cc2nccnc2nn1.CC(C)NCc1ncc2cnc(C(F)(F)F)nc2n1.CC(C)Nc1cc2cc(C(F)(F)F)cnc2nn1.CC(C)Nc1cc2nc(C(F)(F)F)ncc2[nH]c1=O.CC(C)Nc1cc2nccnc2n(C)c1=O.CC(C)Nc1cc2nccnc2nn1.CC(C)Nc1cc2ncncc2[nH]c1=O.CC(C)Nc1cnc2nccnc2c1.CC(C)Nc1cnc2ncsc2c1.CC(C)Nc1nc2cccnc2[nH]c1=O.CC(C)Nc1ncc2cnc(C(F)(F)F)nc2n1.CC(C)Nc1ncc2cncnc2n1.CC(C)Nc1nnc2c(n1)CCCC2.CCc1cc2ncc(NC(C)C)nc2cn1.CCc1nc2ncc(NC(C)C)cc2s1.COc1cc2ncc(NC(C)C)nc2cn1.Cc1ncc2ncc(NC(C)C)cc2n1
InChIInChI=1S/C12H16N4.C11H12F3N5.C11H11F3N4O.C11H11F3N4.C11H15N5.2C11H14N4O.2C11H14N4.C11H15N3S.C10H10F3N5.2C10H12N4O.C10H12N4.C10H16N4.2C9H11N5.C9H11N3S/c1-4-9-5-10-11(6-13-9)16-12(7-14-10)15-8(2)3;1-6(2)15-5-8-16-3-7-4-17-10(11(12,13)14)19-9(7)18-8;1-5(2)16-7-3-6-8(17-9(7)19)4-15-10(18-6)11(12,13)14;1-6(2)16-9-4-7-3-8(11(12,13)14)5-15-10(7)18-17-9;1-8(2)12-4-3-9-7-10-11(16-15-9)14-6-5-13-10;1-7(2)14-10-6-12-8-4-11(16-3)13-5-9(8)15-10;1-7(2)14-9-6-8-10(13-5-4-12-8)15(3)11(9)16;1-7(2)14-9-4-10-11(13-5-9)6-12-8(3)15-10;1-8(2)15(3)10-7-13-11-9(14-10)5-4-6-12-11;1-4-10-14-11-9(15-10)5-8(6-12-11)13-7(2)3;1-5(2)16-9-15-4-6-3-14-8(10(11,12)13)17-7(6)18-9;1-6(2)13-8-3-7-9(14-10(8)15)4-11-5-12-7;1-6(2)12-9-10(15)14-8-7(13-9)4-3-5-11-8;1-7(2)14-8-5-9-10(13-6-8)12-4-3-11-9;1-7(2)11-10-12-8-5-3-4-6-9(8)13-14-10;1-6(2)13-9-11-4-7-3-10-5-12-8(7)14-9;1-6(2)12-8-5-7-9(14-13-8)11-4-3-10-7;1-6(2)12-7-3-8-9(10-4-7)11-5-13-8/h5-8H,4H2,1-3H3,(H,15,16);3-4,6,15H,5H2,1-2H3;3-5,16H,1-2H3,(H,17,19);3-6H,1-2H3,(H,16,17);5-8,12H,3-4H2,1-2H3;4-7H,1-3H3,(H,14,15);4-7,14H,1-3H3;4-7,14H,1-3H3;4-8H,1-3H3;5-7,13H,4H2,1-3H3;3-5H,1-2H3,(H,14,15,16,17,18);3-6,13H,1-2H3,(H,14,15);3-6H,1-2H3,(H,12,13)(H,11,14,15);3-7,14H,1-2H3;7H,3-6H2,1-2H3,(H,11,12,14);3-6H,1-2H3,(H,10,11,12,13,14);3-6H,1-2H3,(H,12,13);3-6,12H,1-2H3
InChIKeyLRGLCFXQIYABBT-UHFFFAOYSA-N
MW3913.55 g/mol
LogP33.37
Rot. Bonds42

About 7-ethyl-N-propan-2-ylpyrido[3,4-b]pyrazin-3-amine;2-ethyl-N-propan-2-yl-[1,3]thiazolo[4,5-b]pyridin-6-amine;7-methoxy-N-propan-2-ylpyrido[3,4-b]pyrazin-3-amine;5-methyl-7-(propan-2-ylamino)pyrido[2,3-b]pyrazin-6-one;N-methyl-N-propan-2-ylpyrido[2,3-b]pyrazin-2-amine;2-methyl-N-propan-2-ylpyrido[3,2-d]pyrimidin-7-amine;2-(propan-2-ylamino)-4H-pyrido[2,3-b]pyrazin-3-one;7-(propan-2-ylamino)-5H-pyrido[3,2-d]pyrimidin-6-one;7-(propan-2-ylamino)-2-(trifluoromethyl)-5H-pyrido[3,2-d]pyrimidin-6-one;N-propan-2-ylpyrazino[2,3-c]pyridazin-3-amine;N-propan-2-ylpyrido[2,3-b]pyrazin-7-amine;N-propan-2-ylpyrimido[4,5-d]pyrimidin-2-amine;N-propan-2-yl-5,6,7,8-tetrahydro-1,2,4-benzotriazin-3-amine;N-propan-2-yl-[1,3]thiazolo[4,5-b]pyridin-6-amine;N-propan-2-yl-6-(trifluoromethyl)pyrido[2,3-c]pyridazin-3-amine;N-propan-2-yl-7-(trifluoromethyl)pyrimido[4,5-d]pyrimidin-2-amine;N-(2-pyrazino[2,3-c]pyridazin-3-ylethyl)propan-2-amine;N-[[2-(trifluoromethyl)pyrimido[4,5-d]pyrimidin-7-yl]methyl]propan-2-amine

7-ethyl-N-propan-2-ylpyrido[3,4-b]pyrazin-3-amine;2-ethyl-N-propan-2-yl-[1,3]thiazolo[4,5-b]pyridin-6-amine;7-methoxy-N-propan-2-ylpyrido[3,4-b]pyrazin-3-amine;5-methyl-7-(propan-2-ylamino)pyrido[2,3-b]pyrazin-6-one;N-methyl-N-propan-2-ylpyrido[2,3-b]pyrazin-2-amine;2-methyl-N-propan-2-ylpyrido[3,2-d]pyrimidin-7-amine;2-(propan-2-ylamino)-4H-pyrido[2,3-b]pyrazin-3-one;7-(propan-2-ylamino)-5H-pyrido[3,2-d]pyrimidin-6-one;7-(propan-2-ylamino)-2-(trifluoromethyl)-5H-pyrido[3,2-d]pyrimidin-6-one;N-propan-2-ylpyrazino[2,3-c]pyridazin-3-amine;N-propan-2-ylpyrido[2,3-b]pyrazin-7-amine;N-propan-2-ylpyrimido[4,5-d]pyrimidin-2-amine;N-propan-2-yl-5,6,7,8-tetrahydro-1,2,4-benzotriazin-3-amine;N-propan-2-yl-[1,3]thiazolo[4,5-b]pyridin-6-amine;N-propan-2-yl-6-(trifluoromethyl)pyrido[2,3-c]pyridazin-3-amine;N-propan-2-yl-7-(trifluoromethyl)pyrimido[4,5-d]pyrimidin-2-amine;N-(2-pyrazino[2,3-c]pyridazin-3-ylethyl)propan-2-amine;N-[[2-(trifluoromethyl)pyrimido[4,5-d]pyrimidin-7-yl]methyl]propan-2-amine (PubChem CID 159433350) has the molecular formula C188H231F12N75O5S2 and a molecular weight of 3913.55 g/mol. Its IUPAC name is 7-ethyl-N-propan-2-ylpyrido[3,4-b]pyrazin-3-amine;2-ethyl-N-propan-2-yl-[1,3]thiazolo[4,5-b]pyridin-6-amine;7-methoxy-N-propan-2-ylpyrido[3,4-b]pyrazin-3-amine;5-methyl-7-(propan-2-ylamino)pyrido[2,3-b]pyrazin-6-one;N-methyl-N-propan-2-ylpyrido[2,3-b]pyrazin-2-amine;2-methyl-N-propan-2-ylpyrido[3,2-d]pyrimidin-7-amine;2-(propan-2-ylamino)-4H-pyrido[2,3-b]pyrazin-3-one;7-(propan-2-ylamino)-5H-pyrido[3,2-d]pyrimidin-6-one;7-(propan-2-ylamino)-2-(trifluoromethyl)-5H-pyrido[3,2-d]pyrimidin-6-one;N-propan-2-ylpyrazino[2,3-c]pyridazin-3-amine;N-propan-2-ylpyrido[2,3-b]pyrazin-7-amine;N-propan-2-ylpyrimido[4,5-d]pyrimidin-2-amine;N-propan-2-yl-5,6,7,8-tetrahydro-1,2,4-benzotriazin-3-amine;N-propan-2-yl-[1,3]thiazolo[4,5-b]pyridin-6-amine;N-propan-2-yl-6-(trifluoromethyl)pyrido[2,3-c]pyridazin-3-amine;N-propan-2-yl-7-(trifluoromethyl)pyrimido[4,5-d]pyrimidin-2-amine;N-(2-pyrazino[2,3-c]pyridazin-3-ylethyl)propan-2-amine;N-[[2-(trifluoromethyl)pyrimido[4,5-d]pyrimidin-7-yl]methyl]propan-2-amine.

Molecular Properties

Compound Name7-ethyl-N-propan-2-ylpyrido[3,4-b]pyrazin-3-amine;2-ethyl-N-propan-2-yl-[1,3]thiazolo[4,5-b]pyridin-6-amine;7-methoxy-N-propan-2-ylpyrido[3,4-b]pyrazin-3-amine;5-methyl-7-(propan-2-ylamino)pyrido[2,3-b]pyrazin-6-one;N-methyl-N-propan-2-ylpyrido[2,3-b]pyrazin-2-amine;2-methyl-N-propan-2-ylpyrido[3,2-d]pyrimidin-7-amine;2-(propan-2-ylamino)-4H-pyrido[2,3-b]pyrazin-3-one;7-(propan-2-ylamino)-5H-pyrido[3,2-d]pyrimidin-6-one;7-(propan-2-ylamino)-2-(trifluoromethyl)-5H-pyrido[3,2-d]pyrimidin-6-one;N-propan-2-ylpyrazino[2,3-c]pyridazin-3-amine;N-propan-2-ylpyrido[2,3-b]pyrazin-7-amine;N-propan-2-ylpyrimido[4,5-d]pyrimidin-2-amine;N-propan-2-yl-5,6,7,8-tetrahydro-1,2,4-benzotriazin-3-amine;N-propan-2-yl-[1,3]thiazolo[4,5-b]pyridin-6-amine;N-propan-2-yl-6-(trifluoromethyl)pyrido[2,3-c]pyridazin-3-amine;N-propan-2-yl-7-(trifluoromethyl)pyrimido[4,5-d]pyrimidin-2-amine;N-(2-pyrazino[2,3-c]pyridazin-3-ylethyl)propan-2-amine;N-[[2-(trifluoromethyl)pyrimido[4,5-d]pyrimidin-7-yl]methyl]propan-2-amine
PubChem CID159433350
Molecular FormulaC188H231F12N75O5S2
Molecular Weight3913.55 g/mol
Exact Mass3910.94
IUPAC Name7-ethyl-N-propan-2-ylpyrido[3,4-b]pyrazin-3-amine;2-ethyl-N-propan-2-yl-[1,3]thiazolo[4,5-b]pyridin-6-amine;7-methoxy-N-propan-2-ylpyrido[3,4-b]pyrazin-3-amine;5-methyl-7-(propan-2-ylamino)pyrido[2,3-b]pyrazin-6-one;N-methyl-N-propan-2-ylpyrido[2,3-b]pyrazin-2-amine;2-methyl-N-propan-2-ylpyrido[3,2-d]pyrimidin-7-amine;2-(propan-2-ylamino)-4H-pyrido[2,3-b]pyrazin-3-one;7-(propan-2-ylamino)-5H-pyrido[3,2-d]pyrimidin-6-one;7-(propan-2-ylamino)-2-(trifluoromethyl)-5H-pyrido[3,2-d]pyrimidin-6-one;N-propan-2-ylpyrazino[2,3-c]pyridazin-3-amine;N-propan-2-ylpyrido[2,3-b]pyrazin-7-amine;N-propan-2-ylpyrimido[4,5-d]pyrimidin-2-amine;N-propan-2-yl-5,6,7,8-tetrahydro-1,2,4-benzotriazin-3-amine;N-propan-2-yl-[1,3]thiazolo[4,5-b]pyridin-6-amine;N-propan-2-yl-6-(trifluoromethyl)pyrido[2,3-c]pyridazin-3-amine;N-propan-2-yl-7-(trifluoromethyl)pyrimido[4,5-d]pyrimidin-2-amine;N-(2-pyrazino[2,3-c]pyridazin-3-ylethyl)propan-2-amine;N-[[2-(trifluoromethyl)pyrimido[4,5-d]pyrimidin-7-yl]methyl]propan-2-amine
SMILESCC(C)N(C)c1cnc2ncccc2n1.CC(C)NCCc1cc2nccnc2nn1.CC(C)NCc1ncc2cnc(C(F)(F)F)nc2n1.CC(C)Nc1cc2cc(C(F)(F)F)cnc2nn1.CC(C)Nc1cc2nc(C(F)(F)F)ncc2[nH]c1=O.CC(C)Nc1cc2nccnc2n(C)c1=O.CC(C)Nc1cc2nccnc2nn1.CC(C)Nc1cc2ncncc2[nH]c1=O.CC(C)Nc1cnc2nccnc2c1.CC(C)Nc1cnc2ncsc2c1.CC(C)Nc1nc2cccnc2[nH]c1=O.CC(C)Nc1ncc2cnc(C(F)(F)F)nc2n1.CC(C)Nc1ncc2cncnc2n1.CC(C)Nc1nnc2c(n1)CCCC2.CCc1cc2ncc(NC(C)C)nc2cn1.CCc1nc2ncc(NC(C)C)cc2s1.COc1cc2ncc(NC(C)C)nc2cn1.Cc1ncc2ncc(NC(C)C)cc2n1
InChIInChI=1S/C12H16N4.C11H12F3N5.C11H11F3N4O.C11H11F3N4.C11H15N5.2C11H14N4O.2C11H14N4.C11H15N3S.C10H10F3N5.2C10H12N4O.C10H12N4.C10H16N4.2C9H11N5.C9H11N3S/c1-4-9-5-10-11(6-13-9)16-12(7-14-10)15-8(2)3;1-6(2)15-5-8-16-3-7-4-17-10(11(12,13)14)19-9(7)18-8;1-5(2)16-7-3-6-8(17-9(7)19)4-15-10(18-6)11(12,13)14;1-6(2)16-9-4-7-3-8(11(12,13)14)5-15-10(7)18-17-9;1-8(2)12-4-3-9-7-10-11(16-15-9)14-6-5-13-10;1-7(2)14-10-6-12-8-4-11(16-3)13-5-9(8)15-10;1-7(2)14-9-6-8-10(13-5-4-12-8)15(3)11(9)16;1-7(2)14-9-4-10-11(13-5-9)6-12-8(3)15-10;1-8(2)15(3)10-7-13-11-9(14-10)5-4-6-12-11;1-4-10-14-11-9(15-10)5-8(6-12-11)13-7(2)3;1-5(2)16-9-15-4-6-3-14-8(10(11,12)13)17-7(6)18-9;1-6(2)13-8-3-7-9(14-10(8)15)4-11-5-12-7;1-6(2)12-9-10(15)14-8-7(13-9)4-3-5-11-8;1-7(2)14-8-5-9-10(13-6-8)12-4-3-11-9;1-7(2)11-10-12-8-5-3-4-6-9(8)13-14-10;1-6(2)13-9-11-4-7-3-10-5-12-8(7)14-9;1-6(2)12-8-5-7-9(14-13-8)11-4-3-10-7;1-6(2)12-7-3-8-9(10-4-7)11-5-13-8/h5-8H,4H2,1-3H3,(H,15,16);3-4,6,15H,5H2,1-2H3;3-5,16H,1-2H3,(H,17,19);3-6H,1-2H3,(H,16,17);5-8,12H,3-4H2,1-2H3;4-7H,1-3H3,(H,14,15);4-7,14H,1-3H3;4-7,14H,1-3H3;4-8H,1-3H3;5-7,13H,4H2,1-3H3;3-5H,1-2H3,(H,14,15,16,17,18);3-6,13H,1-2H3,(H,14,15);3-6H,1-2H3,(H,12,13)(H,11,14,15);3-7,14H,1-2H3;7H,3-6H2,1-2H3,(H,11,12,14);3-6H,1-2H3,(H,10,11,12,13,14);3-6H,1-2H3,(H,12,13);3-6,12H,1-2H3
InChIKeyLRGLCFXQIYABBT-UHFFFAOYSA-N
XLogP33.37
TPSA1020.73 Ų
H-Bond Donors20
H-Bond Acceptors79
Rotatable Bonds42
Heavy Atoms282
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5003913.55
LogP ≤ 533.37
H-Bond Donors ≤ 520
H-Bond Acceptors ≤ 1079

Analyze 7-ethyl-N-propan-2-ylpyrido[3,4-b]pyrazin-3-amine;2-ethyl-N-propan-2-yl-[1,3]thiazolo[4,5-b]pyridin-6-amine;7-methoxy-N-propan-2-ylpyrido[3,4-b]pyrazin-3-amine;5-methyl-7-(propan-2-ylamino)pyrido[2,3-b]pyrazin-6-one;N-methyl-N-propan-2-ylpyrido[2,3-b]pyrazin-2-amine;2-methyl-N-propan-2-ylpyrido[3,2-d]pyrimidin-7-amine;2-(propan-2-ylamino)-4H-pyrido[2,3-b]pyrazin-3-one;7-(propan-2-ylamino)-5H-pyrido[3,2-d]pyrimidin-6-one;7-(propan-2-ylamino)-2-(trifluoromethyl)-5H-pyrido[3,2-d]pyrimidin-6-one;N-propan-2-ylpyrazino[2,3-c]pyridazin-3-amine;N-propan-2-ylpyrido[2,3-b]pyrazin-7-amine;N-propan-2-ylpyrimido[4,5-d]pyrimidin-2-amine;N-propan-2-yl-5,6,7,8-tetrahydro-1,2,4-benzotriazin-3-amine;N-propan-2-yl-[1,3]thiazolo[4,5-b]pyridin-6-amine;N-propan-2-yl-6-(trifluoromethyl)pyrido[2,3-c]pyridazin-3-amine;N-propan-2-yl-7-(trifluoromethyl)pyrimido[4,5-d]pyrimidin-2-amine;N-(2-pyrazino[2,3-c]pyridazin-3-ylethyl)propan-2-amine;N-[[2-(trifluoromethyl)pyrimido[4,5-d]pyrimidin-7-yl]methyl]propan-2-amine with MolForge

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What is the IUPAC name of 7-ethyl-N-propan-2-ylpyrido[3,4-b]pyrazin-3-amine;2-ethyl-N-propan-2-yl-[1,3]thiazolo[4,5-b]pyridin-6-amine;7-methoxy-N-propan-2-ylpyrido[3,4-b]pyrazin-3-amine;5-methyl-7-(propan-2-ylamino)pyrido[2,3-b]pyrazin-6-one;N-methyl-N-propan-2-ylpyrido[2,3-b]pyrazin-2-amine;2-methyl-N-propan-2-ylpyrido[3,2-d]pyrimidin-7-amine;2-(propan-2-ylamino)-4H-pyrido[2,3-b]pyrazin-3-one;7-(propan-2-ylamino)-5H-pyrido[3,2-d]pyrimidin-6-one;7-(propan-2-ylamino)-2-(trifluoromethyl)-5H-pyrido[3,2-d]pyrimidin-6-one;N-propan-2-ylpyrazino[2,3-c]pyridazin-3-amine;N-propan-2-ylpyrido[2,3-b]pyrazin-7-amine;N-propan-2-ylpyrimido[4,5-d]pyrimidin-2-amine;N-propan-2-yl-5,6,7,8-tetrahydro-1,2,4-benzotriazin-3-amine;N-propan-2-yl-[1,3]thiazolo[4,5-b]pyridin-6-amine;N-propan-2-yl-6-(trifluoromethyl)pyrido[2,3-c]pyridazin-3-amine;N-propan-2-yl-7-(trifluoromethyl)pyrimido[4,5-d]pyrimidin-2-amine;N-(2-pyrazino[2,3-c]pyridazin-3-ylethyl)propan-2-amine;N-[[2-(trifluoromethyl)pyrimido[4,5-d]pyrimidin-7-yl]methyl]propan-2-amine?
The IUPAC name of 7-ethyl-N-propan-2-ylpyrido[3,4-b]pyrazin-3-amine;2-ethyl-N-propan-2-yl-[1,3]thiazolo[4,5-b]pyridin-6-amine;7-methoxy-N-propan-2-ylpyrido[3,4-b]pyrazin-3-amine;5-methyl-7-(propan-2-ylamino)pyrido[2,3-b]pyrazin-6-one;N-methyl-N-propan-2-ylpyrido[2,3-b]pyrazin-2-amine;2-methyl-N-propan-2-ylpyrido[3,2-d]pyrimidin-7-amine;2-(propan-2-ylamino)-4H-pyrido[2,3-b]pyrazin-3-one;7-(propan-2-ylamino)-5H-pyrido[3,2-d]pyrimidin-6-one;7-(propan-2-ylamino)-2-(trifluoromethyl)-5H-pyrido[3,2-d]pyrimidin-6-one;N-propan-2-ylpyrazino[2,3-c]pyridazin-3-amine;N-propan-2-ylpyrido[2,3-b]pyrazin-7-amine;N-propan-2-ylpyrimido[4,5-d]pyrimidin-2-amine;N-propan-2-yl-5,6,7,8-tetrahydro-1,2,4-benzotriazin-3-amine;N-propan-2-yl-[1,3]thiazolo[4,5-b]pyridin-6-amine;N-propan-2-yl-6-(trifluoromethyl)pyrido[2,3-c]pyridazin-3-amine;N-propan-2-yl-7-(trifluoromethyl)pyrimido[4,5-d]pyrimidin-2-amine;N-(2-pyrazino[2,3-c]pyridazin-3-ylethyl)propan-2-amine;N-[[2-(trifluoromethyl)pyrimido[4,5-d]pyrimidin-7-yl]methyl]propan-2-amine (CID 159433350) is 7-ethyl-N-propan-2-ylpyrido[3,4-b]pyrazin-3-amine;2-ethyl-N-propan-2-yl-[1,3]thiazolo[4,5-b]pyridin-6-amine;7-methoxy-N-propan-2-ylpyrido[3,4-b]pyrazin-3-amine;5-methyl-7-(propan-2-ylamino)pyrido[2,3-b]pyrazin-6-one;N-methyl-N-propan-2-ylpyrido[2,3-b]pyrazin-2-amine;2-methyl-N-propan-2-ylpyrido[3,2-d]pyrimidin-7-amine;2-(propan-2-ylamino)-4H-pyrido[2,3-b]pyrazin-3-one;7-(propan-2-ylamino)-5H-pyrido[3,2-d]pyrimidin-6-one;7-(propan-2-ylamino)-2-(trifluoromethyl)-5H-pyrido[3,2-d]pyrimidin-6-one;N-propan-2-ylpyrazino[2,3-c]pyridazin-3-amine;N-propan-2-ylpyrido[2,3-b]pyrazin-7-amine;N-propan-2-ylpyrimido[4,5-d]pyrimidin-2-amine;N-propan-2-yl-5,6,7,8-tetrahydro-1,2,4-benzotriazin-3-amine;N-propan-2-yl-[1,3]thiazolo[4,5-b]pyridin-6-amine;N-propan-2-yl-6-(trifluoromethyl)pyrido[2,3-c]pyridazin-3-amine;N-propan-2-yl-7-(trifluoromethyl)pyrimido[4,5-d]pyrimidin-2-amine;N-(2-pyrazino[2,3-c]pyridazin-3-ylethyl)propan-2-amine;N-[[2-(trifluoromethyl)pyrimido[4,5-d]pyrimidin-7-yl]methyl]propan-2-amine.
What is the SMILES notation for 7-ethyl-N-propan-2-ylpyrido[3,4-b]pyrazin-3-amine;2-ethyl-N-propan-2-yl-[1,3]thiazolo[4,5-b]pyridin-6-amine;7-methoxy-N-propan-2-ylpyrido[3,4-b]pyrazin-3-amine;5-methyl-7-(propan-2-ylamino)pyrido[2,3-b]pyrazin-6-one;N-methyl-N-propan-2-ylpyrido[2,3-b]pyrazin-2-amine;2-methyl-N-propan-2-ylpyrido[3,2-d]pyrimidin-7-amine;2-(propan-2-ylamino)-4H-pyrido[2,3-b]pyrazin-3-one;7-(propan-2-ylamino)-5H-pyrido[3,2-d]pyrimidin-6-one;7-(propan-2-ylamino)-2-(trifluoromethyl)-5H-pyrido[3,2-d]pyrimidin-6-one;N-propan-2-ylpyrazino[2,3-c]pyridazin-3-amine;N-propan-2-ylpyrido[2,3-b]pyrazin-7-amine;N-propan-2-ylpyrimido[4,5-d]pyrimidin-2-amine;N-propan-2-yl-5,6,7,8-tetrahydro-1,2,4-benzotriazin-3-amine;N-propan-2-yl-[1,3]thiazolo[4,5-b]pyridin-6-amine;N-propan-2-yl-6-(trifluoromethyl)pyrido[2,3-c]pyridazin-3-amine;N-propan-2-yl-7-(trifluoromethyl)pyrimido[4,5-d]pyrimidin-2-amine;N-(2-pyrazino[2,3-c]pyridazin-3-ylethyl)propan-2-amine;N-[[2-(trifluoromethyl)pyrimido[4,5-d]pyrimidin-7-yl]methyl]propan-2-amine?
The canonical SMILES for 7-ethyl-N-propan-2-ylpyrido[3,4-b]pyrazin-3-amine;2-ethyl-N-propan-2-yl-[1,3]thiazolo[4,5-b]pyridin-6-amine;7-methoxy-N-propan-2-ylpyrido[3,4-b]pyrazin-3-amine;5-methyl-7-(propan-2-ylamino)pyrido[2,3-b]pyrazin-6-one;N-methyl-N-propan-2-ylpyrido[2,3-b]pyrazin-2-amine;2-methyl-N-propan-2-ylpyrido[3,2-d]pyrimidin-7-amine;2-(propan-2-ylamino)-4H-pyrido[2,3-b]pyrazin-3-one;7-(propan-2-ylamino)-5H-pyrido[3,2-d]pyrimidin-6-one;7-(propan-2-ylamino)-2-(trifluoromethyl)-5H-pyrido[3,2-d]pyrimidin-6-one;N-propan-2-ylpyrazino[2,3-c]pyridazin-3-amine;N-propan-2-ylpyrido[2,3-b]pyrazin-7-amine;N-propan-2-ylpyrimido[4,5-d]pyrimidin-2-amine;N-propan-2-yl-5,6,7,8-tetrahydro-1,2,4-benzotriazin-3-amine;N-propan-2-yl-[1,3]thiazolo[4,5-b]pyridin-6-amine;N-propan-2-yl-6-(trifluoromethyl)pyrido[2,3-c]pyridazin-3-amine;N-propan-2-yl-7-(trifluoromethyl)pyrimido[4,5-d]pyrimidin-2-amine;N-(2-pyrazino[2,3-c]pyridazin-3-ylethyl)propan-2-amine;N-[[2-(trifluoromethyl)pyrimido[4,5-d]pyrimidin-7-yl]methyl]propan-2-amine is CC(C)N(C)c1cnc2ncccc2n1.CC(C)NCCc1cc2nccnc2nn1.CC(C)NCc1ncc2cnc(C(F)(F)F)nc2n1.CC(C)Nc1cc2cc(C(F)(F)F)cnc2nn1.CC(C)Nc1cc2nc(C(F)(F)F)ncc2[nH]c1=O.CC(C)Nc1cc2nccnc2n(C)c1=O.CC(C)Nc1cc2nccnc2nn1.CC(C)Nc1cc2ncncc2[nH]c1=O.CC(C)Nc1cnc2nccnc2c1.CC(C)Nc1cnc2ncsc2c1.CC(C)Nc1nc2cccnc2[nH]c1=O.CC(C)Nc1ncc2cnc(C(F)(F)F)nc2n1.CC(C)Nc1ncc2cncnc2n1.CC(C)Nc1nnc2c(n1)CCCC2.CCc1cc2ncc(NC(C)C)nc2cn1.CCc1nc2ncc(NC(C)C)cc2s1.COc1cc2ncc(NC(C)C)nc2cn1.Cc1ncc2ncc(NC(C)C)cc2n1.
What is the InChIKey of 7-ethyl-N-propan-2-ylpyrido[3,4-b]pyrazin-3-amine;2-ethyl-N-propan-2-yl-[1,3]thiazolo[4,5-b]pyridin-6-amine;7-methoxy-N-propan-2-ylpyrido[3,4-b]pyrazin-3-amine;5-methyl-7-(propan-2-ylamino)pyrido[2,3-b]pyrazin-6-one;N-methyl-N-propan-2-ylpyrido[2,3-b]pyrazin-2-amine;2-methyl-N-propan-2-ylpyrido[3,2-d]pyrimidin-7-amine;2-(propan-2-ylamino)-4H-pyrido[2,3-b]pyrazin-3-one;7-(propan-2-ylamino)-5H-pyrido[3,2-d]pyrimidin-6-one;7-(propan-2-ylamino)-2-(trifluoromethyl)-5H-pyrido[3,2-d]pyrimidin-6-one;N-propan-2-ylpyrazino[2,3-c]pyridazin-3-amine;N-propan-2-ylpyrido[2,3-b]pyrazin-7-amine;N-propan-2-ylpyrimido[4,5-d]pyrimidin-2-amine;N-propan-2-yl-5,6,7,8-tetrahydro-1,2,4-benzotriazin-3-amine;N-propan-2-yl-[1,3]thiazolo[4,5-b]pyridin-6-amine;N-propan-2-yl-6-(trifluoromethyl)pyrido[2,3-c]pyridazin-3-amine;N-propan-2-yl-7-(trifluoromethyl)pyrimido[4,5-d]pyrimidin-2-amine;N-(2-pyrazino[2,3-c]pyridazin-3-ylethyl)propan-2-amine;N-[[2-(trifluoromethyl)pyrimido[4,5-d]pyrimidin-7-yl]methyl]propan-2-amine?
The InChIKey is LRGLCFXQIYABBT-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16N4.C11H12F3N5.C11H11F3N4O.C11H11F3N4.C11H15N5.2C11H14N4O.2C11H14N4.C11H15N3S.C10H10F3N5.2C10H12N4O.C10H12N4.C10H16N4.2C9H11N5.C9H11N3S/c1-4-9-5-10-11(6-13-9)16-12(7-14-10)15-8(2)3;1-6(2)15-5-8-16-3-7-4-17-10(11(12,13)14)19-9(7)18-8;1-5(2)16-7-3-6-8(17-9(7)19)4-15-10(18-6)11(12,13)14;1-6(2)16-9-4-7-3-8(11(12,13)14)5-15-10(7)18-17-9;1-8(2)12-4-3-9-7-10-11(16-15-9)14-6-5-13-10;1-7(2)14-10-6-12-8-4-11(16-3)13-5-9(8)15-10;1-7(2)14-9-6-8-10(13-5-4-12-8)15(3)11(9)16;1-7(2)14-9-4-10-11(13-5-9)6-12-8(3)15-10;1-8(2)15(3)10-7-13-11-9(14-10)5-4-6-12-11;1-4-10-14-11-9(15-10)5-8(6-12-11)13-7(2)3;1-5(2)16-9-15-4-6-3-14-8(10(11,12)13)17-7(6)18-9;1-6(2)13-8-3-7-9(14-10(8)15)4-11-5-12-7;1-6(2)12-9-10(15)14-8-7(13-9)4-3-5-11-8;1-7(2)14-8-5-9-10(13-6-8)12-4-3-11-9;1-7(2)11-10-12-8-5-3-4-6-9(8)13-14-10;1-6(2)13-9-11-4-7-3-10-5-12-8(7)14-9;1-6(2)12-8-5-7-9(14-13-8)11-4-3-10-7;1-6(2)12-7-3-8-9(10-4-7)11-5-13-8/h5-8H,4H2,1-3H3,(H,15,16);3-4,6,15H,5H2,1-2H3;3-5,16H,1-2H3,(H,17,19);3-6H,1-2H3,(H,16,17);5-8,12H,3-4H2,1-2H3;4-7H,1-3H3,(H,14,15);4-7,14H,1-3H3;4-7,14H,1-3H3;4-8H,1-3H3;5-7,13H,4H2,1-3H3;3-5H,1-2H3,(H,14,15,16,17,18);3-6,13H,1-2H3,(H,14,15);3-6H,1-2H3,(H,12,13)(H,11,14,15);3-7,14H,1-2H3;7H,3-6H2,1-2H3,(H,11,12,14);3-6H,1-2H3,(H,10,11,12,13,14);3-6H,1-2H3,(H,12,13);3-6,12H,1-2H3.
What are the key properties of 7-ethyl-N-propan-2-ylpyrido[3,4-b]pyrazin-3-amine;2-ethyl-N-propan-2-yl-[1,3]thiazolo[4,5-b]pyridin-6-amine;7-methoxy-N-propan-2-ylpyrido[3,4-b]pyrazin-3-amine;5-methyl-7-(propan-2-ylamino)pyrido[2,3-b]pyrazin-6-one;N-methyl-N-propan-2-ylpyrido[2,3-b]pyrazin-2-amine;2-methyl-N-propan-2-ylpyrido[3,2-d]pyrimidin-7-amine;2-(propan-2-ylamino)-4H-pyrido[2,3-b]pyrazin-3-one;7-(propan-2-ylamino)-5H-pyrido[3,2-d]pyrimidin-6-one;7-(propan-2-ylamino)-2-(trifluoromethyl)-5H-pyrido[3,2-d]pyrimidin-6-one;N-propan-2-ylpyrazino[2,3-c]pyridazin-3-amine;N-propan-2-ylpyrido[2,3-b]pyrazin-7-amine;N-propan-2-ylpyrimido[4,5-d]pyrimidin-2-amine;N-propan-2-yl-5,6,7,8-tetrahydro-1,2,4-benzotriazin-3-amine;N-propan-2-yl-[1,3]thiazolo[4,5-b]pyridin-6-amine;N-propan-2-yl-6-(trifluoromethyl)pyrido[2,3-c]pyridazin-3-amine;N-propan-2-yl-7-(trifluoromethyl)pyrimido[4,5-d]pyrimidin-2-amine;N-(2-pyrazino[2,3-c]pyridazin-3-ylethyl)propan-2-amine;N-[[2-(trifluoromethyl)pyrimido[4,5-d]pyrimidin-7-yl]methyl]propan-2-amine?
7-ethyl-N-propan-2-ylpyrido[3,4-b]pyrazin-3-amine;2-ethyl-N-propan-2-yl-[1,3]thiazolo[4,5-b]pyridin-6-amine;7-methoxy-N-propan-2-ylpyrido[3,4-b]pyrazin-3-amine;5-methyl-7-(propan-2-ylamino)pyrido[2,3-b]pyrazin-6-one;N-methyl-N-propan-2-ylpyrido[2,3-b]pyrazin-2-amine;2-methyl-N-propan-2-ylpyrido[3,2-d]pyrimidin-7-amine;2-(propan-2-ylamino)-4H-pyrido[2,3-b]pyrazin-3-one;7-(propan-2-ylamino)-5H-pyrido[3,2-d]pyrimidin-6-one;7-(propan-2-ylamino)-2-(trifluoromethyl)-5H-pyrido[3,2-d]pyrimidin-6-one;N-propan-2-ylpyrazino[2,3-c]pyridazin-3-amine;N-propan-2-ylpyrido[2,3-b]pyrazin-7-amine;N-propan-2-ylpyrimido[4,5-d]pyrimidin-2-amine;N-propan-2-yl-5,6,7,8-tetrahydro-1,2,4-benzotriazin-3-amine;N-propan-2-yl-[1,3]thiazolo[4,5-b]pyridin-6-amine;N-propan-2-yl-6-(trifluoromethyl)pyrido[2,3-c]pyridazin-3-amine;N-propan-2-yl-7-(trifluoromethyl)pyrimido[4,5-d]pyrimidin-2-amine;N-(2-pyrazino[2,3-c]pyridazin-3-ylethyl)propan-2-amine;N-[[2-(trifluoromethyl)pyrimido[4,5-d]pyrimidin-7-yl]methyl]propan-2-amine has a molecular weight of 3913.55 g/mol, XLogP of 33.37, 42 rotatable bonds, 20 hydrogen bond donors, and 79 hydrogen bond acceptors.
Where does this data come from?
All data for 7-ethyl-N-propan-2-ylpyrido[3,4-b]pyrazin-3-amine;2-ethyl-N-propan-2-yl-[1,3]thiazolo[4,5-b]pyridin-6-amine;7-methoxy-N-propan-2-ylpyrido[3,4-b]pyrazin-3-amine;5-methyl-7-(propan-2-ylamino)pyrido[2,3-b]pyrazin-6-one;N-methyl-N-propan-2-ylpyrido[2,3-b]pyrazin-2-amine;2-methyl-N-propan-2-ylpyrido[3,2-d]pyrimidin-7-amine;2-(propan-2-ylamino)-4H-pyrido[2,3-b]pyrazin-3-one;7-(propan-2-ylamino)-5H-pyrido[3,2-d]pyrimidin-6-one;7-(propan-2-ylamino)-2-(trifluoromethyl)-5H-pyrido[3,2-d]pyrimidin-6-one;N-propan-2-ylpyrazino[2,3-c]pyridazin-3-amine;N-propan-2-ylpyrido[2,3-b]pyrazin-7-amine;N-propan-2-ylpyrimido[4,5-d]pyrimidin-2-amine;N-propan-2-yl-5,6,7,8-tetrahydro-1,2,4-benzotriazin-3-amine;N-propan-2-yl-[1,3]thiazolo[4,5-b]pyridin-6-amine;N-propan-2-yl-6-(trifluoromethyl)pyrido[2,3-c]pyridazin-3-amine;N-propan-2-yl-7-(trifluoromethyl)pyrimido[4,5-d]pyrimidin-2-amine;N-(2-pyrazino[2,3-c]pyridazin-3-ylethyl)propan-2-amine;N-[[2-(trifluoromethyl)pyrimido[4,5-d]pyrimidin-7-yl]methyl]propan-2-amine is sourced from PubChem (CID 159433350), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).