1-(2-aminopyrimidin-4-yl)-N-[(2-chlorophenyl)methyl]indole-4-carboxamide;1-(2-aminopyrimidin-4-yl)-N-[(3-chlorophenyl)methyl]indole-4-carboxamide;1-(2-aminopyrimidin-4-yl)-N-[(4-chlorophenyl)methyl]indole-4-carboxamide;1-(2-aminopyrimidin-4-yl)-N-[(3-fluorophenyl)methyl]indole-4-carboxamide;1-(2-aminopyrimidin-4-yl)-N-[(4-fluorophenyl)methyl]indole-4-carboxamide;1-(2-aminopyrimidin-4-yl)-N-[(3-methoxyphenyl)methyl]indole-4-carboxamide;1-(2-aminopyrimidin-4-yl)-N-(1-phenylethyl)indole-4-carboxamide

C142H118Cl3F2N35O8 — CID 158575781

IUPAC1-(2-aminopyrimidin-4-yl)-N-[(2-chlorophenyl)methyl]indole-4-carboxamide;1-(2-aminopyrimidin-4-yl)-N-[(3-chlorophenyl)methyl]indole-4-carboxamide;1-(2-aminopyrimidin-4-yl)-N-[(4-chlorophenyl)methyl]indole-4-carboxamide;1-(2-aminopyrimidin-4-yl)-N-[(3-fluorophenyl)methyl]indole-4-carboxamide;1-(2-aminopyrimidin-4-yl)-N-[(4-fluorophenyl)methyl]indole-4-carboxamide;1-(2-aminopyrimidin-4-yl)-N-[(3-methoxyphenyl)methyl]indole-4-carboxamide;1-(2-aminopyrimidin-4-yl)-N-(1-phenylethyl)indole-4-carboxamide
SMILESCC(NC(=O)c1cccc2c1ccn2-c1ccnc(N)n1)c1ccccc1.COc1cccc(CNC(=O)c2cccc3c2ccn3-c2ccnc(N)n2)c1.Nc1nccc(-n2ccc3c(C(=O)NCc4ccc(Cl)cc4)cccc32)n1.Nc1nccc(-n2ccc3c(C(=O)NCc4ccc(F)cc4)cccc32)n1.Nc1nccc(-n2ccc3c(C(=O)NCc4cccc(Cl)c4)cccc32)n1.Nc1nccc(-n2ccc3c(C(=O)NCc4cccc(F)c4)cccc32)n1.Nc1nccc(-n2ccc3c(C(=O)NCc4ccccc4Cl)cccc32)n1
InChIInChI=1S/C21H19N5O2.C21H19N5O.3C20H16ClN5O.2C20H16FN5O/c1-28-15-5-2-4-14(12-15)13-24-20(27)17-6-3-7-18-16(17)9-11-26(18)19-8-10-23-21(22)25-19;1-14(15-6-3-2-4-7-15)24-20(27)17-8-5-9-18-16(17)11-13-26(18)19-10-12-23-21(22)25-19;21-14-4-1-3-13(11-14)12-24-19(27)16-5-2-6-17-15(16)8-10-26(17)18-7-9-23-20(22)25-18;21-16-6-2-1-4-13(16)12-24-19(27)15-5-3-7-17-14(15)9-11-26(17)18-8-10-23-20(22)25-18;21-14-6-4-13(5-7-14)12-24-19(27)16-2-1-3-17-15(16)9-11-26(17)18-8-10-23-20(22)25-18;21-14-4-1-3-13(11-14)12-24-19(27)16-5-2-6-17-15(16)8-10-26(17)18-7-9-23-20(22)25-18;21-14-6-4-13(5-7-14)12-24-19(27)16-2-1-3-17-15(16)9-11-26(17)18-8-10-23-20(22)25-18/h2-12H,13H2,1H3,(H,24,27)(H2,22,23,25);2-14H,1H3,(H,24,27)(H2,22,23,25);5*1-11H,12H2,(H,24,27)(H2,22,23,25)
InChIKeyHSQHHCREUZTNMD-UHFFFAOYSA-N
MW2587.10 g/mol
LogP23.34
Rot. Bonds29

About 1-(2-aminopyrimidin-4-yl)-N-[(2-chlorophenyl)methyl]indole-4-carboxamide;1-(2-aminopyrimidin-4-yl)-N-[(3-chlorophenyl)methyl]indole-4-carboxamide;1-(2-aminopyrimidin-4-yl)-N-[(4-chlorophenyl)methyl]indole-4-carboxamide;1-(2-aminopyrimidin-4-yl)-N-[(3-fluorophenyl)methyl]indole-4-carboxamide;1-(2-aminopyrimidin-4-yl)-N-[(4-fluorophenyl)methyl]indole-4-carboxamide;1-(2-aminopyrimidin-4-yl)-N-[(3-methoxyphenyl)methyl]indole-4-carboxamide;1-(2-aminopyrimidin-4-yl)-N-(1-phenylethyl)indole-4-carboxamide

1-(2-aminopyrimidin-4-yl)-N-[(2-chlorophenyl)methyl]indole-4-carboxamide;1-(2-aminopyrimidin-4-yl)-N-[(3-chlorophenyl)methyl]indole-4-carboxamide;1-(2-aminopyrimidin-4-yl)-N-[(4-chlorophenyl)methyl]indole-4-carboxamide;1-(2-aminopyrimidin-4-yl)-N-[(3-fluorophenyl)methyl]indole-4-carboxamide;1-(2-aminopyrimidin-4-yl)-N-[(4-fluorophenyl)methyl]indole-4-carboxamide;1-(2-aminopyrimidin-4-yl)-N-[(3-methoxyphenyl)methyl]indole-4-carboxamide;1-(2-aminopyrimidin-4-yl)-N-(1-phenylethyl)indole-4-carboxamide (PubChem CID 158575781) has the molecular formula C142H118Cl3F2N35O8 and a molecular weight of 2587.10 g/mol. Its IUPAC name is 1-(2-aminopyrimidin-4-yl)-N-[(2-chlorophenyl)methyl]indole-4-carboxamide;1-(2-aminopyrimidin-4-yl)-N-[(3-chlorophenyl)methyl]indole-4-carboxamide;1-(2-aminopyrimidin-4-yl)-N-[(4-chlorophenyl)methyl]indole-4-carboxamide;1-(2-aminopyrimidin-4-yl)-N-[(3-fluorophenyl)methyl]indole-4-carboxamide;1-(2-aminopyrimidin-4-yl)-N-[(4-fluorophenyl)methyl]indole-4-carboxamide;1-(2-aminopyrimidin-4-yl)-N-[(3-methoxyphenyl)methyl]indole-4-carboxamide;1-(2-aminopyrimidin-4-yl)-N-(1-phenylethyl)indole-4-carboxamide.

Molecular Properties

Compound Name1-(2-aminopyrimidin-4-yl)-N-[(2-chlorophenyl)methyl]indole-4-carboxamide;1-(2-aminopyrimidin-4-yl)-N-[(3-chlorophenyl)methyl]indole-4-carboxamide;1-(2-aminopyrimidin-4-yl)-N-[(4-chlorophenyl)methyl]indole-4-carboxamide;1-(2-aminopyrimidin-4-yl)-N-[(3-fluorophenyl)methyl]indole-4-carboxamide;1-(2-aminopyrimidin-4-yl)-N-[(4-fluorophenyl)methyl]indole-4-carboxamide;1-(2-aminopyrimidin-4-yl)-N-[(3-methoxyphenyl)methyl]indole-4-carboxamide;1-(2-aminopyrimidin-4-yl)-N-(1-phenylethyl)indole-4-carboxamide
PubChem CID158575781
Molecular FormulaC142H118Cl3F2N35O8
Molecular Weight2587.10 g/mol
Exact Mass2583.89
IUPAC Name1-(2-aminopyrimidin-4-yl)-N-[(2-chlorophenyl)methyl]indole-4-carboxamide;1-(2-aminopyrimidin-4-yl)-N-[(3-chlorophenyl)methyl]indole-4-carboxamide;1-(2-aminopyrimidin-4-yl)-N-[(4-chlorophenyl)methyl]indole-4-carboxamide;1-(2-aminopyrimidin-4-yl)-N-[(3-fluorophenyl)methyl]indole-4-carboxamide;1-(2-aminopyrimidin-4-yl)-N-[(4-fluorophenyl)methyl]indole-4-carboxamide;1-(2-aminopyrimidin-4-yl)-N-[(3-methoxyphenyl)methyl]indole-4-carboxamide;1-(2-aminopyrimidin-4-yl)-N-(1-phenylethyl)indole-4-carboxamide
SMILESCC(NC(=O)c1cccc2c1ccn2-c1ccnc(N)n1)c1ccccc1.COc1cccc(CNC(=O)c2cccc3c2ccn3-c2ccnc(N)n2)c1.Nc1nccc(-n2ccc3c(C(=O)NCc4ccc(Cl)cc4)cccc32)n1.Nc1nccc(-n2ccc3c(C(=O)NCc4ccc(F)cc4)cccc32)n1.Nc1nccc(-n2ccc3c(C(=O)NCc4cccc(Cl)c4)cccc32)n1.Nc1nccc(-n2ccc3c(C(=O)NCc4cccc(F)c4)cccc32)n1.Nc1nccc(-n2ccc3c(C(=O)NCc4ccccc4Cl)cccc32)n1
InChIInChI=1S/C21H19N5O2.C21H19N5O.3C20H16ClN5O.2C20H16FN5O/c1-28-15-5-2-4-14(12-15)13-24-20(27)17-6-3-7-18-16(17)9-11-26(18)19-8-10-23-21(22)25-19;1-14(15-6-3-2-4-7-15)24-20(27)17-8-5-9-18-16(17)11-13-26(18)19-10-12-23-21(22)25-19;21-14-4-1-3-13(11-14)12-24-19(27)16-5-2-6-17-15(16)8-10-26(17)18-7-9-23-20(22)25-18;21-16-6-2-1-4-13(16)12-24-19(27)15-5-3-7-17-14(15)9-11-26(17)18-8-10-23-20(22)25-18;21-14-6-4-13(5-7-14)12-24-19(27)16-2-1-3-17-15(16)9-11-26(17)18-8-10-23-20(22)25-18;21-14-4-1-3-13(11-14)12-24-19(27)16-5-2-6-17-15(16)8-10-26(17)18-7-9-23-20(22)25-18;21-14-6-4-13(5-7-14)12-24-19(27)16-2-1-3-17-15(16)9-11-26(17)18-8-10-23-20(22)25-18/h2-12H,13H2,1H3,(H,24,27)(H2,22,23,25);2-14H,1H3,(H,24,27)(H2,22,23,25);5*1-11H,12H2,(H,24,27)(H2,22,23,25)
InChIKeyHSQHHCREUZTNMD-UHFFFAOYSA-N
XLogP23.34
TPSA610.04 Ų
H-Bond Donors14
H-Bond Acceptors36
Rotatable Bonds29
Heavy Atoms190
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002587.10
LogP ≤ 523.34
H-Bond Donors ≤ 514
H-Bond Acceptors ≤ 1036

Analyze 1-(2-aminopyrimidin-4-yl)-N-[(2-chlorophenyl)methyl]indole-4-carboxamide;1-(2-aminopyrimidin-4-yl)-N-[(3-chlorophenyl)methyl]indole-4-carboxamide;1-(2-aminopyrimidin-4-yl)-N-[(4-chlorophenyl)methyl]indole-4-carboxamide;1-(2-aminopyrimidin-4-yl)-N-[(3-fluorophenyl)methyl]indole-4-carboxamide;1-(2-aminopyrimidin-4-yl)-N-[(4-fluorophenyl)methyl]indole-4-carboxamide;1-(2-aminopyrimidin-4-yl)-N-[(3-methoxyphenyl)methyl]indole-4-carboxamide;1-(2-aminopyrimidin-4-yl)-N-(1-phenylethyl)indole-4-carboxamide with MolForge

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Related Compounds

[(2S)-2-[5-[(3S)-3-aminopyrrolidin-1-yl]-6-methylpyrazolo[1,5-a]pyrimidin-2-yl]piperidin-1-yl]-(2-fluoro-6-methoxyphenyl)methanone;[5-chloro-2-(trifluoromethyl)phenyl]-[(2S)-2-[6-methyl-5-[(3S)-3-methylpyrrolidin-1-yl]pyrazolo[1,5-a]pyrimidin-2-yl]piperidin-1-yl]methanone;(5-ethyl-2-pyridinyl)-[(2S)-2-[6-methyl-5-[(3S)-3-methylpyrrolidin-1-yl]pyrazolo[1,5-a]pyrimidin-2-yl]piperidin-1-yl]methanone;(3-fluoro-6-methoxy-2-pyridinyl)-[(2S)-2-[6-methyl-5-[(3S)-3-methylpyrrolidin-1-yl]pyrazolo[1,5-a]pyrimidin-2-yl]piperidin-1-yl]methanone;[5-fluoro-2-(trifluoromethyl)phenyl]-[(2S)-2-[6-methyl-5-[(3S)-3-methylpyrrolidin-1-yl]pyrazolo[1,5-a]pyrimidin-2-yl]piperidin-1-yl]methanone;1H-indazol-4-yl-[(2S)-2-[6-methyl-5-[(3S)-3-methylpyrrolidin-1-yl]pyrazolo[1,5-a]pyrimidin-2-yl]piperidin-1-yl]methanone
CID 157211173
1-[2-(2-Chloro-3-methylanilino)pyrimidin-4-yl]indole-3-carboxamide;1-[2-(3,4-dimethoxyanilino)pyrimidin-4-yl]indole-3-carboxamide;1-[2-(3-fluoro-5-methylanilino)pyrimidin-4-yl]indole-3-carboxamide;bis(1-[2-(4-fluoro-3-methylanilino)pyrimidin-4-yl]indole-3-carboxamide);1-[2-[3-methyl-4-(trifluoromethyl)anilino]pyrimidin-4-yl]indole-3-carboxamide
CID 158471375
N-[(1S)-1-(8-chloro-1-oxo-2-phenylisoquinolin-3-yl)ethyl]-2-methylpyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[(1S)-1-(8-methoxy-1-oxo-2-phenylisoquinolin-3-yl)ethyl]-2-methylpyrazolo[1,5-a]pyrimidine-3-carboxamide;2-methyl-N-[(1S)-1-[1-oxo-2-phenyl-8-(propan-2-ylamino)isoquinolin-3-yl]ethyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-methyl-N-[(1S)-1-[1-oxo-2-phenyl-8-(2,2,2-trifluoroethylamino)isoquinolin-3-yl]ethyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 158924573
[(2S)-2-[5-[(3S)-3-aminopyrrolidin-1-yl]-6-methylpyrazolo[1,5-a]pyrimidin-2-yl]piperidin-1-yl]-(2-fluoro-6-methoxyphenyl)methanone;[5-chloro-2-(trifluoromethyl)phenyl]-[(2S)-2-[6-methyl-5-[(3S)-3-methylpyrrolidin-1-yl]pyrazolo[1,5-a]pyrimidin-2-yl]piperidin-1-yl]methanone;(5-ethyl-2-pyridinyl)-[(2S)-2-[6-methyl-5-[(3S)-3-methylpyrrolidin-1-yl]pyrazolo[1,5-a]pyrimidin-2-yl]piperidin-1-yl]methanone;(3-fluoro-6-methoxy-2-pyridinyl)-[(2S)-2-[6-methyl-5-[(3S)-3-methylpyrrolidin-1-yl]pyrazolo[1,5-a]pyrimidin-2-yl]piperidin-1-yl]methanone;[5-fluoro-2-(trifluoromethyl)phenyl]-[(2S)-2-[6-methyl-5-[(3S)-3-methylpyrrolidin-1-yl]pyrazolo[1,5-a]pyrimidin-2-yl]piperidin-1-yl]methanone;1H-indazol-4-yl-[(2S)-2-[6-methyl-5-[(3S)-3-methylpyrrolidin-1-yl]pyrazolo[1,5-a]pyrimidin-2-yl]piperidin-1-yl]methanone;methane
CID 159406793
N-[3-acetyl-1-[2-[(2S,4R)-2-[(3-chloro-2-fluorophenyl)methylcarbamoyl]-4-fluoropyrrolidin-1-yl]-2-oxoethyl]indol-5-yl]-3-fluoro-3-methylpiperidine-1-carboxamide;N-[3-acetyl-1-[2-[(2S,4R)-2-[(3-chloro-2-fluorophenyl)methylcarbamoyl]-4-fluoropyrrolidin-1-yl]-2-oxoethyl]indol-5-yl]-3-fluoro-3-methylpyrrolidine-1-carboxamide;(2S,4R)-1-[2-[3-acetyl-5-(cyclopropylcarbamoylamino)indol-1-yl]acetyl]-4-fluoro-N-[2-fluoro-3-(trifluoromethoxy)phenyl]pyrrolidine-2-carboxamide;(2S,4R)-1-[2-[3-acetyl-5-(pyrimidin-2-ylmethylcarbamoylamino)indol-1-yl]acetyl]-N-[(3-chloro-2-fluorophenyl)methyl]-4-fluoropyrrolidine-2-carboxamide;methane
CID 159449986
[5-chloro-2-(trifluoromethyl)phenyl]-[(2S)-2-[6-methyl-5-[(3S)-3-methylpyrrolidin-1-yl]pyrazolo[1,5-a]pyrimidin-2-yl]piperidin-1-yl]methanone;(3-fluoro-6-methoxy-2-pyridinyl)-[(2S)-2-[6-methyl-5-[(3S)-3-methylpyrrolidin-1-yl]pyrazolo[1,5-a]pyrimidin-2-yl]piperidin-1-yl]methanone;[5-fluoro-2-(trifluoromethyl)phenyl]-[(2S)-2-[6-methyl-5-[(3S)-3-methylpyrrolidin-1-yl]pyrazolo[1,5-a]pyrimidin-2-yl]piperidin-1-yl]methanone;1H-indazol-4-yl-[(2S)-2-[6-methyl-5-[(3S)-3-methylpyrrolidin-1-yl]pyrazolo[1,5-a]pyrimidin-2-yl]piperidin-1-yl]methanone
CID 159787021
CID 160335025
CID 160335025
CID 160498773
CID 160498773
3-[4-[4-[5-(4-chlorophenyl)pyrimidin-2-yl]piperazin-1-yl]butyl]-5-isocyano-1H-indole;3-[3-[4-[5-(4-chlorophenyl)pyrimidin-2-yl]piperazin-1-yl]propyl]-5-isocyano-1H-indole;3-[4-[4-[5-(2,4-difluorophenyl)pyrimidin-2-yl]piperazin-1-yl]butyl]-5-isocyano-1H-indole;3-[3-[4-[5-(2,4-difluorophenyl)pyrimidin-2-yl]piperazin-1-yl]propyl]-5-isocyano-1H-indole;3-[3-[4-[5-(4-fluoro-2-methoxyphenyl)pyrimidin-2-yl]piperazin-1-yl]propyl]-5-isocyano-1H-indole;3-[4-[4-[5-(4-fluoro-2-methylphenyl)pyrimidin-2-yl]piperazin-1-yl]butyl]-5-isocyano-1H-indole;4-[2-[4-[4-(5-isocyano-1H-indol-3-yl)butyl]piperazin-1-yl]pyrimidin-5-yl]-2-(2,2,3-trifluorobutoxy)benzamide;4-[2-[4-[3-(5-isocyano-1H-indol-3-yl)propyl]piperazin-1-yl]pyrimidin-5-yl]-2-(2,2,3-trifluorobutoxy)benzamide
CID 160722965
5-(6-chloro-5-fluoro-3-pyridinyl)-6-[(3S)-3-ethylpyrrolidin-1-yl]-N-[4-(trifluoromethoxy)phenyl]pyridine-3-carboxamide;5-(6-chloro-3-pyridinyl)-6-[(3S)-3-ethylpyrrolidin-1-yl]-N-[4-(trifluoromethoxy)phenyl]pyridine-3-carboxamide;5-(6-cyclopropyl-3-pyridinyl)-6-[(3S)-3-ethylpyrrolidin-1-yl]-N-[4-(trifluoromethoxy)phenyl]pyridine-3-carboxamide;6-[(3S)-3-ethylpyrrolidin-1-yl]-5-(5-fluoro-6-methyl-3-pyridinyl)-N-[4-(trifluoromethoxy)phenyl]pyridine-3-carboxamide;6-[(3S)-3-ethylpyrrolidin-1-yl]-5-[6-(fluoromethyl)-3-pyridinyl]-N-[4-(trifluoromethoxy)phenyl]pyridine-3-carboxamide;6-[(3S)-3-ethylpyrrolidin-1-yl]-5-(5-fluoro-3-pyridinyl)-N-[4-(trifluoromethoxy)phenyl]pyridine-3-carboxamide
CID 161139725
[5-chloro-2-(trifluoromethyl)phenyl]-[(2S)-2-[6-methyl-5-[(3S)-3-methylpyrrolidin-1-yl]pyrazolo[1,5-a]pyrimidin-2-yl]piperidin-1-yl]methanone;[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-[(2S)-2-[6-methyl-5-[(3S)-3-methylpyrrolidin-1-yl]pyrazolo[1,5-a]pyrimidin-2-yl]piperidin-1-yl]methanone;[5-chloro-3-(trifluoromethyl)-2-pyridinyl]-[(2S)-2-[6-methyl-5-[(3S)-3-methylpyrrolidin-1-yl]pyrazolo[1,5-a]pyrimidin-2-yl]piperidin-1-yl]methanone;(3-fluoro-6-methoxy-2-pyridinyl)-[(2S)-2-[6-methyl-5-[(3S)-3-methylpyrrolidin-1-yl]pyrazolo[1,5-a]pyrimidin-2-yl]piperidin-1-yl]methanone;[5-fluoro-2-(trifluoromethyl)phenyl]-[(2S)-2-[6-methyl-5-[(3S)-3-methylpyrrolidin-1-yl]pyrazolo[1,5-a]pyrimidin-2-yl]piperidin-1-yl]methanone;1H-indazol-4-yl-[(2S)-2-[6-methyl-5-[(3S)-3-methylpyrrolidin-1-yl]pyrazolo[1,5-a]pyrimidin-2-yl]piperidin-1-yl]methanone
CID 161181302
6-[2-[(3R)-4-acetyl-3-methylpiperazin-1-yl]pyrimidin-5-yl]-1-[(2-chloro-5-methylphenyl)methyl]-2-methylpyrazolo[3,4-b]pyridin-3-one;6-[2-[(3R)-4-acetyl-3-methylpiperazin-1-yl]pyrimidin-5-yl]-1-[[2-(difluoromethoxy)-5-methylphenyl]methyl]-2-methylpyrazolo[3,4-b]pyridin-3-one;6-[2-[(3R)-4-acetyl-3-methylpiperazin-1-yl]pyrimidin-5-yl]-2-methyl-1-[[6-methyl-3-(trifluoromethyl)-2-pyridinyl]methyl]indazol-3-one;(8aS)-7-[5-[2-methyl-1-[[6-methyl-3-(trifluoromethyl)-2-pyridinyl]methyl]-3-oxoindazol-6-yl]pyrimidin-2-yl]-1,2,5,6,8,8a-hexahydroimidazo[1,5-a]pyrazin-3-one;1-[[2-(difluoromethoxy)phenyl]methyl]-6-[2-[(2R,4S)-4-hydroxy-2-methylpiperidin-1-yl]pyrimidin-5-yl]-2-methylindazol-3-one
CID 161379446

Frequently Asked Questions

What is the IUPAC name of 1-(2-aminopyrimidin-4-yl)-N-[(2-chlorophenyl)methyl]indole-4-carboxamide;1-(2-aminopyrimidin-4-yl)-N-[(3-chlorophenyl)methyl]indole-4-carboxamide;1-(2-aminopyrimidin-4-yl)-N-[(4-chlorophenyl)methyl]indole-4-carboxamide;1-(2-aminopyrimidin-4-yl)-N-[(3-fluorophenyl)methyl]indole-4-carboxamide;1-(2-aminopyrimidin-4-yl)-N-[(4-fluorophenyl)methyl]indole-4-carboxamide;1-(2-aminopyrimidin-4-yl)-N-[(3-methoxyphenyl)methyl]indole-4-carboxamide;1-(2-aminopyrimidin-4-yl)-N-(1-phenylethyl)indole-4-carboxamide?
The IUPAC name of 1-(2-aminopyrimidin-4-yl)-N-[(2-chlorophenyl)methyl]indole-4-carboxamide;1-(2-aminopyrimidin-4-yl)-N-[(3-chlorophenyl)methyl]indole-4-carboxamide;1-(2-aminopyrimidin-4-yl)-N-[(4-chlorophenyl)methyl]indole-4-carboxamide;1-(2-aminopyrimidin-4-yl)-N-[(3-fluorophenyl)methyl]indole-4-carboxamide;1-(2-aminopyrimidin-4-yl)-N-[(4-fluorophenyl)methyl]indole-4-carboxamide;1-(2-aminopyrimidin-4-yl)-N-[(3-methoxyphenyl)methyl]indole-4-carboxamide;1-(2-aminopyrimidin-4-yl)-N-(1-phenylethyl)indole-4-carboxamide (CID 158575781) is 1-(2-aminopyrimidin-4-yl)-N-[(2-chlorophenyl)methyl]indole-4-carboxamide;1-(2-aminopyrimidin-4-yl)-N-[(3-chlorophenyl)methyl]indole-4-carboxamide;1-(2-aminopyrimidin-4-yl)-N-[(4-chlorophenyl)methyl]indole-4-carboxamide;1-(2-aminopyrimidin-4-yl)-N-[(3-fluorophenyl)methyl]indole-4-carboxamide;1-(2-aminopyrimidin-4-yl)-N-[(4-fluorophenyl)methyl]indole-4-carboxamide;1-(2-aminopyrimidin-4-yl)-N-[(3-methoxyphenyl)methyl]indole-4-carboxamide;1-(2-aminopyrimidin-4-yl)-N-(1-phenylethyl)indole-4-carboxamide.
What is the SMILES notation for 1-(2-aminopyrimidin-4-yl)-N-[(2-chlorophenyl)methyl]indole-4-carboxamide;1-(2-aminopyrimidin-4-yl)-N-[(3-chlorophenyl)methyl]indole-4-carboxamide;1-(2-aminopyrimidin-4-yl)-N-[(4-chlorophenyl)methyl]indole-4-carboxamide;1-(2-aminopyrimidin-4-yl)-N-[(3-fluorophenyl)methyl]indole-4-carboxamide;1-(2-aminopyrimidin-4-yl)-N-[(4-fluorophenyl)methyl]indole-4-carboxamide;1-(2-aminopyrimidin-4-yl)-N-[(3-methoxyphenyl)methyl]indole-4-carboxamide;1-(2-aminopyrimidin-4-yl)-N-(1-phenylethyl)indole-4-carboxamide?
The canonical SMILES for 1-(2-aminopyrimidin-4-yl)-N-[(2-chlorophenyl)methyl]indole-4-carboxamide;1-(2-aminopyrimidin-4-yl)-N-[(3-chlorophenyl)methyl]indole-4-carboxamide;1-(2-aminopyrimidin-4-yl)-N-[(4-chlorophenyl)methyl]indole-4-carboxamide;1-(2-aminopyrimidin-4-yl)-N-[(3-fluorophenyl)methyl]indole-4-carboxamide;1-(2-aminopyrimidin-4-yl)-N-[(4-fluorophenyl)methyl]indole-4-carboxamide;1-(2-aminopyrimidin-4-yl)-N-[(3-methoxyphenyl)methyl]indole-4-carboxamide;1-(2-aminopyrimidin-4-yl)-N-(1-phenylethyl)indole-4-carboxamide is CC(NC(=O)c1cccc2c1ccn2-c1ccnc(N)n1)c1ccccc1.COc1cccc(CNC(=O)c2cccc3c2ccn3-c2ccnc(N)n2)c1.Nc1nccc(-n2ccc3c(C(=O)NCc4ccc(Cl)cc4)cccc32)n1.Nc1nccc(-n2ccc3c(C(=O)NCc4ccc(F)cc4)cccc32)n1.Nc1nccc(-n2ccc3c(C(=O)NCc4cccc(Cl)c4)cccc32)n1.Nc1nccc(-n2ccc3c(C(=O)NCc4cccc(F)c4)cccc32)n1.Nc1nccc(-n2ccc3c(C(=O)NCc4ccccc4Cl)cccc32)n1.
What is the InChIKey of 1-(2-aminopyrimidin-4-yl)-N-[(2-chlorophenyl)methyl]indole-4-carboxamide;1-(2-aminopyrimidin-4-yl)-N-[(3-chlorophenyl)methyl]indole-4-carboxamide;1-(2-aminopyrimidin-4-yl)-N-[(4-chlorophenyl)methyl]indole-4-carboxamide;1-(2-aminopyrimidin-4-yl)-N-[(3-fluorophenyl)methyl]indole-4-carboxamide;1-(2-aminopyrimidin-4-yl)-N-[(4-fluorophenyl)methyl]indole-4-carboxamide;1-(2-aminopyrimidin-4-yl)-N-[(3-methoxyphenyl)methyl]indole-4-carboxamide;1-(2-aminopyrimidin-4-yl)-N-(1-phenylethyl)indole-4-carboxamide?
The InChIKey is HSQHHCREUZTNMD-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H19N5O2.C21H19N5O.3C20H16ClN5O.2C20H16FN5O/c1-28-15-5-2-4-14(12-15)13-24-20(27)17-6-3-7-18-16(17)9-11-26(18)19-8-10-23-21(22)25-19;1-14(15-6-3-2-4-7-15)24-20(27)17-8-5-9-18-16(17)11-13-26(18)19-10-12-23-21(22)25-19;21-14-4-1-3-13(11-14)12-24-19(27)16-5-2-6-17-15(16)8-10-26(17)18-7-9-23-20(22)25-18;21-16-6-2-1-4-13(16)12-24-19(27)15-5-3-7-17-14(15)9-11-26(17)18-8-10-23-20(22)25-18;21-14-6-4-13(5-7-14)12-24-19(27)16-2-1-3-17-15(16)9-11-26(17)18-8-10-23-20(22)25-18;21-14-4-1-3-13(11-14)12-24-19(27)16-5-2-6-17-15(16)8-10-26(17)18-7-9-23-20(22)25-18;21-14-6-4-13(5-7-14)12-24-19(27)16-2-1-3-17-15(16)9-11-26(17)18-8-10-23-20(22)25-18/h2-12H,13H2,1H3,(H,24,27)(H2,22,23,25);2-14H,1H3,(H,24,27)(H2,22,23,25);5*1-11H,12H2,(H,24,27)(H2,22,23,25).
What are the key properties of 1-(2-aminopyrimidin-4-yl)-N-[(2-chlorophenyl)methyl]indole-4-carboxamide;1-(2-aminopyrimidin-4-yl)-N-[(3-chlorophenyl)methyl]indole-4-carboxamide;1-(2-aminopyrimidin-4-yl)-N-[(4-chlorophenyl)methyl]indole-4-carboxamide;1-(2-aminopyrimidin-4-yl)-N-[(3-fluorophenyl)methyl]indole-4-carboxamide;1-(2-aminopyrimidin-4-yl)-N-[(4-fluorophenyl)methyl]indole-4-carboxamide;1-(2-aminopyrimidin-4-yl)-N-[(3-methoxyphenyl)methyl]indole-4-carboxamide;1-(2-aminopyrimidin-4-yl)-N-(1-phenylethyl)indole-4-carboxamide?
1-(2-aminopyrimidin-4-yl)-N-[(2-chlorophenyl)methyl]indole-4-carboxamide;1-(2-aminopyrimidin-4-yl)-N-[(3-chlorophenyl)methyl]indole-4-carboxamide;1-(2-aminopyrimidin-4-yl)-N-[(4-chlorophenyl)methyl]indole-4-carboxamide;1-(2-aminopyrimidin-4-yl)-N-[(3-fluorophenyl)methyl]indole-4-carboxamide;1-(2-aminopyrimidin-4-yl)-N-[(4-fluorophenyl)methyl]indole-4-carboxamide;1-(2-aminopyrimidin-4-yl)-N-[(3-methoxyphenyl)methyl]indole-4-carboxamide;1-(2-aminopyrimidin-4-yl)-N-(1-phenylethyl)indole-4-carboxamide has a molecular weight of 2587.10 g/mol, XLogP of 23.34, 29 rotatable bonds, 14 hydrogen bond donors, and 36 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-aminopyrimidin-4-yl)-N-[(2-chlorophenyl)methyl]indole-4-carboxamide;1-(2-aminopyrimidin-4-yl)-N-[(3-chlorophenyl)methyl]indole-4-carboxamide;1-(2-aminopyrimidin-4-yl)-N-[(4-chlorophenyl)methyl]indole-4-carboxamide;1-(2-aminopyrimidin-4-yl)-N-[(3-fluorophenyl)methyl]indole-4-carboxamide;1-(2-aminopyrimidin-4-yl)-N-[(4-fluorophenyl)methyl]indole-4-carboxamide;1-(2-aminopyrimidin-4-yl)-N-[(3-methoxyphenyl)methyl]indole-4-carboxamide;1-(2-aminopyrimidin-4-yl)-N-(1-phenylethyl)indole-4-carboxamide is sourced from PubChem (CID 158575781), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).