N-[2-amino-5-(furan-2-yl)phenyl]-1-methyl-2-oxo-3H-indole-5-carboxamide;[4-[4-amino-3-[(1-methyl-2-oxo-3H-indole-5-carbonyl)amino]phenyl]phenyl] methanesulfonate;N-(2-amino-5-phenylphenyl)-1-(2-morpholin-4-ylethyl)benzimidazole-5-carboxamide;N-(2-amino-5-phenylphenyl)-3-(2-morpholin-4-ylethyl)benzimidazole-5-carboxamide;N-(2-amino-5-thiophen-2-ylphenyl)-3,3-difluoro-1-methyl-2-oxoindole-5-carboxamide;N-(2-amino-5-thiophen-2-ylphenyl)-3H-indole-6-carboxamide;N-(2-amino-5-thiophen-2-ylphenyl)-1-(3-morpholin-4-ylpropyl)-2-oxo-3H-indole-5-carboxamide;N-(2-amino-5-thiophen-2-ylphenyl)-2-oxo-1-(2-piperidin-1-ylethyl)-3H-indole-5-carboxamide

C186H178F2N30O20S5 — CID 163747803

IUPACN-[2-amino-5-(furan-2-yl)phenyl]-1-methyl-2-oxo-3H-indole-5-carboxamide;[4-[4-amino-3-[(1-methyl-2-oxo-3H-indole-5-carbonyl)amino]phenyl]phenyl] methanesulfonate;N-(2-amino-5-phenylphenyl)-1-(2-morpholin-4-ylethyl)benzimidazole-5-carboxamide;N-(2-amino-5-phenylphenyl)-3-(2-morpholin-4-ylethyl)benzimidazole-5-carboxamide;N-(2-amino-5-thiophen-2-ylphenyl)-3,3-difluoro-1-methyl-2-oxoindole-5-carboxamide;N-(2-amino-5-thiophen-2-ylphenyl)-3H-indole-6-carboxamide;N-(2-amino-5-thiophen-2-ylphenyl)-1-(3-morpholin-4-ylpropyl)-2-oxo-3H-indole-5-carboxamide;N-(2-amino-5-thiophen-2-ylphenyl)-2-oxo-1-(2-piperidin-1-ylethyl)-3H-indole-5-carboxamide
SMILESCN1C(=O)C(F)(F)c2cc(C(=O)Nc3cc(-c4cccs4)ccc3N)ccc21.CN1C(=O)Cc2cc(C(=O)Nc3cc(-c4ccc(OS(C)(=O)=O)cc4)ccc3N)ccc21.CN1C(=O)Cc2cc(C(=O)Nc3cc(-c4ccco4)ccc3N)ccc21.Nc1ccc(-c2ccccc2)cc1NC(=O)c1ccc2c(c1)ncn2CCN1CCOCC1.Nc1ccc(-c2ccccc2)cc1NC(=O)c1ccc2ncn(CCN3CCOCC3)c2c1.Nc1ccc(-c2cccs2)cc1NC(=O)c1ccc2c(c1)CC(=O)N2CCCN1CCOCC1.Nc1ccc(-c2cccs2)cc1NC(=O)c1ccc2c(c1)CC(=O)N2CCN1CCCCC1.Nc1ccc(-c2cccs2)cc1NC(=O)c1ccc2c(c1)N=CC2
InChIInChI=1S/2C26H27N5O2.C26H28N4O3S.C26H28N4O2S.C23H21N3O5S.C20H15F2N3O2S.C20H17N3O3.C19H15N3OS/c27-22-8-6-20(19-4-2-1-3-5-19)16-23(22)29-26(32)21-7-9-25-24(17-21)28-18-31(25)11-10-30-12-14-33-15-13-30;27-22-8-6-20(19-4-2-1-3-5-19)16-24(22)29-26(32)21-7-9-23-25(17-21)31(18-28-23)11-10-30-12-14-33-15-13-30;27-21-6-4-18(24-3-1-14-34-24)16-22(21)28-26(32)19-5-7-23-20(15-19)17-25(31)30(23)9-2-8-29-10-12-33-13-11-29;27-21-8-6-18(24-5-4-14-33-24)16-22(21)28-26(32)19-7-9-23-20(15-19)17-25(31)30(23)13-12-29-10-2-1-3-11-29;1-26-21-10-6-16(11-17(21)13-22(26)27)23(28)25-20-12-15(5-9-19(20)24)14-3-7-18(8-4-14)31-32(2,29)30;1-25-16-7-5-12(9-13(16)20(21,22)19(25)27)18(26)24-15-10-11(4-6-14(15)23)17-3-2-8-28-17;1-23-17-7-5-13(9-14(17)11-19(23)24)20(25)22-16-10-12(4-6-15(16)21)18-3-2-8-26-18;20-15-6-5-13(18-2-1-9-24-18)10-17(15)22-19(23)14-4-3-12-7-8-21-16(12)11-14/h2*1-9,16-18H,10-15,27H2,(H,29,32);1,3-7,14-16H,2,8-13,17,27H2,(H,28,32);4-9,14-16H,1-3,10-13,17,27H2,(H,28,32);3-12H,13,24H2,1-2H3,(H,25,28);2-10H,23H2,1H3,(H,24,26);2-10H,11,21H2,1H3,(H,22,25);1-6,8-11H,7,20H2,(H,22,23)
InChIKeyLNJPWBFBQUNVER-UHFFFAOYSA-N
MW3351.99 g/mol
LogP31.40
Rot. Bonds39

About N-[2-amino-5-(furan-2-yl)phenyl]-1-methyl-2-oxo-3H-indole-5-carboxamide;[4-[4-amino-3-[(1-methyl-2-oxo-3H-indole-5-carbonyl)amino]phenyl]phenyl] methanesulfonate;N-(2-amino-5-phenylphenyl)-1-(2-morpholin-4-ylethyl)benzimidazole-5-carboxamide;N-(2-amino-5-phenylphenyl)-3-(2-morpholin-4-ylethyl)benzimidazole-5-carboxamide;N-(2-amino-5-thiophen-2-ylphenyl)-3,3-difluoro-1-methyl-2-oxoindole-5-carboxamide;N-(2-amino-5-thiophen-2-ylphenyl)-3H-indole-6-carboxamide;N-(2-amino-5-thiophen-2-ylphenyl)-1-(3-morpholin-4-ylpropyl)-2-oxo-3H-indole-5-carboxamide;N-(2-amino-5-thiophen-2-ylphenyl)-2-oxo-1-(2-piperidin-1-ylethyl)-3H-indole-5-carboxamide

N-[2-amino-5-(furan-2-yl)phenyl]-1-methyl-2-oxo-3H-indole-5-carboxamide;[4-[4-amino-3-[(1-methyl-2-oxo-3H-indole-5-carbonyl)amino]phenyl]phenyl] methanesulfonate;N-(2-amino-5-phenylphenyl)-1-(2-morpholin-4-ylethyl)benzimidazole-5-carboxamide;N-(2-amino-5-phenylphenyl)-3-(2-morpholin-4-ylethyl)benzimidazole-5-carboxamide;N-(2-amino-5-thiophen-2-ylphenyl)-3,3-difluoro-1-methyl-2-oxoindole-5-carboxamide;N-(2-amino-5-thiophen-2-ylphenyl)-3H-indole-6-carboxamide;N-(2-amino-5-thiophen-2-ylphenyl)-1-(3-morpholin-4-ylpropyl)-2-oxo-3H-indole-5-carboxamide;N-(2-amino-5-thiophen-2-ylphenyl)-2-oxo-1-(2-piperidin-1-ylethyl)-3H-indole-5-carboxamide (PubChem CID 163747803) has the molecular formula C186H178F2N30O20S5 and a molecular weight of 3351.99 g/mol. Its IUPAC name is N-[2-amino-5-(furan-2-yl)phenyl]-1-methyl-2-oxo-3H-indole-5-carboxamide;[4-[4-amino-3-[(1-methyl-2-oxo-3H-indole-5-carbonyl)amino]phenyl]phenyl] methanesulfonate;N-(2-amino-5-phenylphenyl)-1-(2-morpholin-4-ylethyl)benzimidazole-5-carboxamide;N-(2-amino-5-phenylphenyl)-3-(2-morpholin-4-ylethyl)benzimidazole-5-carboxamide;N-(2-amino-5-thiophen-2-ylphenyl)-3,3-difluoro-1-methyl-2-oxoindole-5-carboxamide;N-(2-amino-5-thiophen-2-ylphenyl)-3H-indole-6-carboxamide;N-(2-amino-5-thiophen-2-ylphenyl)-1-(3-morpholin-4-ylpropyl)-2-oxo-3H-indole-5-carboxamide;N-(2-amino-5-thiophen-2-ylphenyl)-2-oxo-1-(2-piperidin-1-ylethyl)-3H-indole-5-carboxamide.

Molecular Properties

Compound NameN-[2-amino-5-(furan-2-yl)phenyl]-1-methyl-2-oxo-3H-indole-5-carboxamide;[4-[4-amino-3-[(1-methyl-2-oxo-3H-indole-5-carbonyl)amino]phenyl]phenyl] methanesulfonate;N-(2-amino-5-phenylphenyl)-1-(2-morpholin-4-ylethyl)benzimidazole-5-carboxamide;N-(2-amino-5-phenylphenyl)-3-(2-morpholin-4-ylethyl)benzimidazole-5-carboxamide;N-(2-amino-5-thiophen-2-ylphenyl)-3,3-difluoro-1-methyl-2-oxoindole-5-carboxamide;N-(2-amino-5-thiophen-2-ylphenyl)-3H-indole-6-carboxamide;N-(2-amino-5-thiophen-2-ylphenyl)-1-(3-morpholin-4-ylpropyl)-2-oxo-3H-indole-5-carboxamide;N-(2-amino-5-thiophen-2-ylphenyl)-2-oxo-1-(2-piperidin-1-ylethyl)-3H-indole-5-carboxamide
PubChem CID163747803
Molecular FormulaC186H178F2N30O20S5
Molecular Weight3351.99 g/mol
Exact Mass3349.24
IUPAC NameN-[2-amino-5-(furan-2-yl)phenyl]-1-methyl-2-oxo-3H-indole-5-carboxamide;[4-[4-amino-3-[(1-methyl-2-oxo-3H-indole-5-carbonyl)amino]phenyl]phenyl] methanesulfonate;N-(2-amino-5-phenylphenyl)-1-(2-morpholin-4-ylethyl)benzimidazole-5-carboxamide;N-(2-amino-5-phenylphenyl)-3-(2-morpholin-4-ylethyl)benzimidazole-5-carboxamide;N-(2-amino-5-thiophen-2-ylphenyl)-3,3-difluoro-1-methyl-2-oxoindole-5-carboxamide;N-(2-amino-5-thiophen-2-ylphenyl)-3H-indole-6-carboxamide;N-(2-amino-5-thiophen-2-ylphenyl)-1-(3-morpholin-4-ylpropyl)-2-oxo-3H-indole-5-carboxamide;N-(2-amino-5-thiophen-2-ylphenyl)-2-oxo-1-(2-piperidin-1-ylethyl)-3H-indole-5-carboxamide
SMILESCN1C(=O)C(F)(F)c2cc(C(=O)Nc3cc(-c4cccs4)ccc3N)ccc21.CN1C(=O)Cc2cc(C(=O)Nc3cc(-c4ccc(OS(C)(=O)=O)cc4)ccc3N)ccc21.CN1C(=O)Cc2cc(C(=O)Nc3cc(-c4ccco4)ccc3N)ccc21.Nc1ccc(-c2ccccc2)cc1NC(=O)c1ccc2c(c1)ncn2CCN1CCOCC1.Nc1ccc(-c2ccccc2)cc1NC(=O)c1ccc2ncn(CCN3CCOCC3)c2c1.Nc1ccc(-c2cccs2)cc1NC(=O)c1ccc2c(c1)CC(=O)N2CCCN1CCOCC1.Nc1ccc(-c2cccs2)cc1NC(=O)c1ccc2c(c1)CC(=O)N2CCN1CCCCC1.Nc1ccc(-c2cccs2)cc1NC(=O)c1ccc2c(c1)N=CC2
InChIInChI=1S/2C26H27N5O2.C26H28N4O3S.C26H28N4O2S.C23H21N3O5S.C20H15F2N3O2S.C20H17N3O3.C19H15N3OS/c27-22-8-6-20(19-4-2-1-3-5-19)16-23(22)29-26(32)21-7-9-25-24(17-21)28-18-31(25)11-10-30-12-14-33-15-13-30;27-22-8-6-20(19-4-2-1-3-5-19)16-24(22)29-26(32)21-7-9-23-25(17-21)31(18-28-23)11-10-30-12-14-33-15-13-30;27-21-6-4-18(24-3-1-14-34-24)16-22(21)28-26(32)19-5-7-23-20(15-19)17-25(31)30(23)9-2-8-29-10-12-33-13-11-29;27-21-8-6-18(24-5-4-14-33-24)16-22(21)28-26(32)19-7-9-23-20(15-19)17-25(31)30(23)13-12-29-10-2-1-3-11-29;1-26-21-10-6-16(11-17(21)13-22(26)27)23(28)25-20-12-15(5-9-19(20)24)14-3-7-18(8-4-14)31-32(2,29)30;1-25-16-7-5-12(9-13(16)20(21,22)19(25)27)18(26)24-15-10-11(4-6-14(15)23)17-3-2-8-28-17;1-23-17-7-5-13(9-14(17)11-19(23)24)20(25)22-16-10-12(4-6-15(16)21)18-3-2-8-26-18;20-15-6-5-13(18-2-1-9-24-18)10-17(15)22-19(23)14-4-3-12-7-8-21-16(12)11-14/h2*1-9,16-18H,10-15,27H2,(H,29,32);1,3-7,14-16H,2,8-13,17,27H2,(H,28,32);4-9,14-16H,1-3,10-13,17,27H2,(H,28,32);3-12H,13,24H2,1-2H3,(H,25,28);2-10H,23H2,1H3,(H,24,26);2-10H,11,21H2,1H3,(H,22,25);1-6,8-11H,7,20H2,(H,22,23)
InChIKeyLNJPWBFBQUNVER-UHFFFAOYSA-N
XLogP31.40
TPSA687.67 Ų
H-Bond Donors16
H-Bond Acceptors41
Rotatable Bonds39
Heavy Atoms243
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5003351.99
LogP ≤ 531.40
H-Bond Donors ≤ 516
H-Bond Acceptors ≤ 1041

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}, {'alert_name': 'Sulfonic_acid_1', 'substructure': 'N/A'}

Analyze N-[2-amino-5-(furan-2-yl)phenyl]-1-methyl-2-oxo-3H-indole-5-carboxamide;[4-[4-amino-3-[(1-methyl-2-oxo-3H-indole-5-carbonyl)amino]phenyl]phenyl] methanesulfonate;N-(2-amino-5-phenylphenyl)-1-(2-morpholin-4-ylethyl)benzimidazole-5-carboxamide;N-(2-amino-5-phenylphenyl)-3-(2-morpholin-4-ylethyl)benzimidazole-5-carboxamide;N-(2-amino-5-thiophen-2-ylphenyl)-3,3-difluoro-1-methyl-2-oxoindole-5-carboxamide;N-(2-amino-5-thiophen-2-ylphenyl)-3H-indole-6-carboxamide;N-(2-amino-5-thiophen-2-ylphenyl)-1-(3-morpholin-4-ylpropyl)-2-oxo-3H-indole-5-carboxamide;N-(2-amino-5-thiophen-2-ylphenyl)-2-oxo-1-(2-piperidin-1-ylethyl)-3H-indole-5-carboxamide with MolForge

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Related Compounds

CID 157886959
CID 157886959
N-[3-[[4-(1-benzofuran-2-yl)-5H-pyrrolo[3,2-d]pyrimidin-2-yl]methyl]-4-methylphenyl]-3-(trifluoromethyl)benzamide;N-[3-[[4-(furan-2-yl)-5H-pyrrolo[3,2-d]pyrimidin-2-yl]methyl]-4-methylphenyl]-3-(trifluoromethyl)benzamide;N-[4-methyl-3-[(4-phenyl-5H-pyrrolo[3,2-d]pyrimidin-2-yl)methyl]phenyl]-3-(trifluoromethyl)benzamide;N-[4-methyl-3-[(4-thiophen-2-yl-5H-pyrrolo[3,2-d]pyrimidin-2-yl)methyl]phenyl]-3-(trifluoromethyl)benzamide
CID 159780650
CID 160697594
CID 160697594
3-[[4-(furan-2-yl)-5H-pyrrolo[3,2-d]pyrimidin-2-yl]methyl]-4-methyl-N-[2-methyl-5-(trifluoromethyl)phenyl]benzamide;N-[3-[[4-(4-methoxyphenyl)-5H-pyrrolo[3,2-d]pyrimidin-2-yl]methyl]-4-methylphenyl]-3-(trifluoromethyl)benzamide;N-[4-methyl-3-[[4-(4-methylsulfonylphenyl)-5H-pyrrolo[3,2-d]pyrimidin-2-yl]methyl]phenyl]-3-(trifluoromethyl)benzamide;4-methyl-N-[2-methyl-5-(trifluoromethyl)phenyl]-3-[(4-phenyl-5H-pyrrolo[3,2-d]pyrimidin-2-yl)methyl]benzamide
CID 162140082
2-(5-tert-butyl-2-methylbenzimidazol-1-yl)-N,N-dimethylethanamine;N,N-dimethyl-2-(6-propan-2-yl-1-benzofuran-3-yl)ethanamine;N,N-dimethyl-2-(6-propan-2-yl-1-benzothiophen-3-yl)ethanamine;N,N-dimethyl-1-(7-propan-2-yl-1,3-dihydro-2-benzothiophen-4-yl)piperidin-4-amine;N,N-dimethyl-1-(4-propan-2-yl-2,3-dihydro-1H-pyrrolo[3,2-c]pyridin-7-yl)piperidin-4-amine;N,N-dimethyl-2-(5-propan-2-ylimidazo[4,5-b]pyridin-1-yl)ethanamine;N,N-dimethyl-2-(5-propan-2-ylindol-1-yl)ethanamine;N,N-dimethyl-2-(5-propan-2-ylpyrrolo[3,2-b]pyridin-1-yl)ethanamine;N,N-dimethyl-2-[5-propan-2-yl-2-(trifluoromethyl)benzimidazol-1-yl]ethanamine
CID 167592122
N-[[4-[2-(2-amino-3-pyridinyl)-5-(furan-2-yl)imidazo[4,5-b]pyridin-3-yl]phenyl]methyl]-3-fluorobenzamide;2-[4-[2-(2-amino-3-pyridinyl)-6-pyridin-3-ylimidazo[4,5-b]pyridin-3-yl]phenyl]-N-(2-methylquinolin-6-yl)acetamide;N-[[4-[2-(2-amino-3-pyridinyl)-5-thiophen-3-ylimidazo[4,5-b]pyridin-3-yl]phenyl]methyl]-3-fluorobenzamide
CID 89120208
Methyl 2-[3-butyl-2-(furan-2-yl)benzimidazol-4-yl]-1-(2-methylpropyl)benzimidazole-5-carboxylate;methyl 1-(2-cyclohex-2-en-1-ylethyl)-2-(2,3-dibutylbenzimidazol-4-yl)benzimidazole-5-carboxylate;methyl 1-(2-cyclohex-2-en-1-ylethyl)-2-[3-(3,3-diphenylpropyl)benzimidazol-4-yl]benzimidazole-5-carboxylate;methyl 1-(2-cyclohex-2-en-1-ylethyl)-2-[3-(thiophen-2-ylmethyl)benzimidazol-4-yl]benzimidazole-5-carboxylate;methyl 1-(2-cyclohex-2-en-1-ylethyl)-2-[2-thiophen-2-yl-3-(thiophen-2-ylmethyl)benzimidazol-4-yl]benzimidazole-5-carboxylate;methyl 1-(3-methoxypropyl)-2-[2-(2-phenylethylamino)-3-(3-phenylpropyl)benzimidazol-4-yl]benzimidazole-5-carboxylate
CID 157850236
1-N-[3-(2,3-dihydro-1-benzofuran-5-yl)imidazo[1,2-a]pyrazin-8-yl]-3-N,3-N-dimethylbenzene-1,3-diamine;4-[8-[3-(dimethylamino)anilino]imidazo[1,2-a]pyrazin-3-yl]benzamide;1-[5-[8-[3-(dimethylamino)anilino]imidazo[1,2-a]pyrazin-3-yl]thiophen-2-yl]ethanone;3-N,3-N-dimethyl-1-N-[3-(4-methylsulfinylphenyl)imidazo[1,2-a]pyrazin-8-yl]benzene-1,3-diamine;3-N,3-N-dimethyl-1-N-[3-(4-methylthiophen-2-yl)imidazo[1,2-a]pyrazin-8-yl]benzene-1,3-diamine;3-N,3-N-dimethyl-1-N-[3-(2-morpholin-4-ylphenyl)imidazo[1,2-a]pyrazin-8-yl]benzene-1,3-diamine;3-N,3-N-dimethyl-1-N-[3-(3-pyrrolidin-1-ylphenyl)imidazo[1,2-a]pyrazin-8-yl]benzene-1,3-diamine
CID 158860058
2-[4-[[(2S)-1-(furan-2-yl)propan-2-yl]amino]-2-oxo-1H-pyridin-3-yl]-6-(2-pyrrolidin-1-ylethyl)-3H-pyrrolo[3,4-f]benzimidazole-5,7-dione;6-[2-[methyl(2-methylsulfonylethyl)amino]ethyl]-2-[4-[[(2S)-1-(3-methylthiophen-2-yl)propan-2-yl]amino]-2-oxo-1H-pyridin-3-yl]-3,7-dihydropyrrolo[3,4-f]indol-5-one;6-[2-[methyl(2-methylsulfonylethyl)amino]ethyl]-2-[4-[[(2S)-1-(3-methylthiophen-2-yl)propan-2-yl]amino]-2-oxo-1H-pyridin-3-yl]-3H-pyrrolo[3,4-f]indole-5,7-dione;2-[4-[[(2S)-1-(2-methylphenyl)propan-2-yl]amino]-2-oxo-1H-pyridin-3-yl]-6-(2-pyrrolidin-1-ylethyl)-3,5-dihydropyrrolo[3,4-f]benzimidazol-7-one;2-[4-[[(2S)-1-(2-methylphenyl)propan-2-yl]amino]-2-oxo-1H-pyridin-3-yl]-6-(2-pyrrolidin-1-ylethyl)-3H-pyrrolo[3,4-f]benzimidazole-5,7-dione
CID 159494333
2-[(1R)-4-(benzimidazol-1-yl)-1-(3,4-dimethoxyphenyl)butyl]-4-(4-ethylpiperazin-1-yl)-3H-isoindol-1-one;4-(4-cyclopropylpiperazin-1-yl)-2-[(1R)-1-(3,4-dimethoxyphenyl)-4-phenoxybutyl]-3H-isoindol-1-one;N-[(4R)-4-(3,4-dimethoxyphenyl)-4-(3-oxo-7-piperazin-1-yl-1H-isoindol-2-yl)butyl]-N-methylthiophene-2-sulfonamide
CID 159820837
4-[1-(3-fluorophenyl)benzimidazol-5-yl]-N-(2-piperidin-1-ylethyl)benzamide;5-(4-methylsulfonylphenyl)-1-phenylbenzimidazole;4-(1-phenylbenzimidazol-5-yl)benzamide;2-[4-(1-phenylbenzimidazol-5-yl)phenoxy]-N-(2-piperidin-1-ylethyl)acetamide;4-(1-phenylbenzimidazol-5-yl)-N-(2-piperidin-1-ylethyl)benzamide
CID 160195006
(4R)-N-[4-[chloro(difluoro)methoxy]phenyl]-6-(furan-3-yl)-4-methyl-3,4-dihydro-1H-[1,4]oxazino[4,3-a]benzimidazole-8-carboxamide;(4R)-N-[4-[chloro(difluoro)methoxy]phenyl]-4-methyl-6-(5-methyl-3-pyridinyl)-3,4-dihydro-2H-[1,3]oxazino[3,2-a]benzimidazole-8-carboxamide;(4R)-N-[4-[chloro(difluoro)methoxy]phenyl]-4-methyl-6-pyridin-3-yl-3,4-dihydro-1H-[1,4]oxazino[4,3-a]benzimidazole-8-carboxamide;(4R)-N-[4-[chloro(difluoro)methoxy]phenyl]-4-methyl-6-(1,3-thiazol-2-yl)-3,4-dihydro-1H-[1,4]oxazino[4,3-a]benzimidazole-8-carboxamide;(4R)-N-[4-[chloro(difluoro)methoxy]phenyl]-4-methyl-6-(1,3-thiazol-4-yl)-3,4-dihydro-2H-[1,3]oxazino[3,2-a]benzimidazole-8-carboxamide;(4R)-N-[4-[chloro(difluoro)methoxy]phenyl]-4-methyl-6-thiophen-2-yl-3,4-dihydro-1H-[1,4]oxazino[4,3-a]benzimidazole-8-carboxamide
CID 160566802

Frequently Asked Questions

What is the IUPAC name of N-[2-amino-5-(furan-2-yl)phenyl]-1-methyl-2-oxo-3H-indole-5-carboxamide;[4-[4-amino-3-[(1-methyl-2-oxo-3H-indole-5-carbonyl)amino]phenyl]phenyl] methanesulfonate;N-(2-amino-5-phenylphenyl)-1-(2-morpholin-4-ylethyl)benzimidazole-5-carboxamide;N-(2-amino-5-phenylphenyl)-3-(2-morpholin-4-ylethyl)benzimidazole-5-carboxamide;N-(2-amino-5-thiophen-2-ylphenyl)-3,3-difluoro-1-methyl-2-oxoindole-5-carboxamide;N-(2-amino-5-thiophen-2-ylphenyl)-3H-indole-6-carboxamide;N-(2-amino-5-thiophen-2-ylphenyl)-1-(3-morpholin-4-ylpropyl)-2-oxo-3H-indole-5-carboxamide;N-(2-amino-5-thiophen-2-ylphenyl)-2-oxo-1-(2-piperidin-1-ylethyl)-3H-indole-5-carboxamide?
The IUPAC name of N-[2-amino-5-(furan-2-yl)phenyl]-1-methyl-2-oxo-3H-indole-5-carboxamide;[4-[4-amino-3-[(1-methyl-2-oxo-3H-indole-5-carbonyl)amino]phenyl]phenyl] methanesulfonate;N-(2-amino-5-phenylphenyl)-1-(2-morpholin-4-ylethyl)benzimidazole-5-carboxamide;N-(2-amino-5-phenylphenyl)-3-(2-morpholin-4-ylethyl)benzimidazole-5-carboxamide;N-(2-amino-5-thiophen-2-ylphenyl)-3,3-difluoro-1-methyl-2-oxoindole-5-carboxamide;N-(2-amino-5-thiophen-2-ylphenyl)-3H-indole-6-carboxamide;N-(2-amino-5-thiophen-2-ylphenyl)-1-(3-morpholin-4-ylpropyl)-2-oxo-3H-indole-5-carboxamide;N-(2-amino-5-thiophen-2-ylphenyl)-2-oxo-1-(2-piperidin-1-ylethyl)-3H-indole-5-carboxamide (CID 163747803) is N-[2-amino-5-(furan-2-yl)phenyl]-1-methyl-2-oxo-3H-indole-5-carboxamide;[4-[4-amino-3-[(1-methyl-2-oxo-3H-indole-5-carbonyl)amino]phenyl]phenyl] methanesulfonate;N-(2-amino-5-phenylphenyl)-1-(2-morpholin-4-ylethyl)benzimidazole-5-carboxamide;N-(2-amino-5-phenylphenyl)-3-(2-morpholin-4-ylethyl)benzimidazole-5-carboxamide;N-(2-amino-5-thiophen-2-ylphenyl)-3,3-difluoro-1-methyl-2-oxoindole-5-carboxamide;N-(2-amino-5-thiophen-2-ylphenyl)-3H-indole-6-carboxamide;N-(2-amino-5-thiophen-2-ylphenyl)-1-(3-morpholin-4-ylpropyl)-2-oxo-3H-indole-5-carboxamide;N-(2-amino-5-thiophen-2-ylphenyl)-2-oxo-1-(2-piperidin-1-ylethyl)-3H-indole-5-carboxamide.
What is the SMILES notation for N-[2-amino-5-(furan-2-yl)phenyl]-1-methyl-2-oxo-3H-indole-5-carboxamide;[4-[4-amino-3-[(1-methyl-2-oxo-3H-indole-5-carbonyl)amino]phenyl]phenyl] methanesulfonate;N-(2-amino-5-phenylphenyl)-1-(2-morpholin-4-ylethyl)benzimidazole-5-carboxamide;N-(2-amino-5-phenylphenyl)-3-(2-morpholin-4-ylethyl)benzimidazole-5-carboxamide;N-(2-amino-5-thiophen-2-ylphenyl)-3,3-difluoro-1-methyl-2-oxoindole-5-carboxamide;N-(2-amino-5-thiophen-2-ylphenyl)-3H-indole-6-carboxamide;N-(2-amino-5-thiophen-2-ylphenyl)-1-(3-morpholin-4-ylpropyl)-2-oxo-3H-indole-5-carboxamide;N-(2-amino-5-thiophen-2-ylphenyl)-2-oxo-1-(2-piperidin-1-ylethyl)-3H-indole-5-carboxamide?
The canonical SMILES for N-[2-amino-5-(furan-2-yl)phenyl]-1-methyl-2-oxo-3H-indole-5-carboxamide;[4-[4-amino-3-[(1-methyl-2-oxo-3H-indole-5-carbonyl)amino]phenyl]phenyl] methanesulfonate;N-(2-amino-5-phenylphenyl)-1-(2-morpholin-4-ylethyl)benzimidazole-5-carboxamide;N-(2-amino-5-phenylphenyl)-3-(2-morpholin-4-ylethyl)benzimidazole-5-carboxamide;N-(2-amino-5-thiophen-2-ylphenyl)-3,3-difluoro-1-methyl-2-oxoindole-5-carboxamide;N-(2-amino-5-thiophen-2-ylphenyl)-3H-indole-6-carboxamide;N-(2-amino-5-thiophen-2-ylphenyl)-1-(3-morpholin-4-ylpropyl)-2-oxo-3H-indole-5-carboxamide;N-(2-amino-5-thiophen-2-ylphenyl)-2-oxo-1-(2-piperidin-1-ylethyl)-3H-indole-5-carboxamide is CN1C(=O)C(F)(F)c2cc(C(=O)Nc3cc(-c4cccs4)ccc3N)ccc21.CN1C(=O)Cc2cc(C(=O)Nc3cc(-c4ccc(OS(C)(=O)=O)cc4)ccc3N)ccc21.CN1C(=O)Cc2cc(C(=O)Nc3cc(-c4ccco4)ccc3N)ccc21.Nc1ccc(-c2ccccc2)cc1NC(=O)c1ccc2c(c1)ncn2CCN1CCOCC1.Nc1ccc(-c2ccccc2)cc1NC(=O)c1ccc2ncn(CCN3CCOCC3)c2c1.Nc1ccc(-c2cccs2)cc1NC(=O)c1ccc2c(c1)CC(=O)N2CCCN1CCOCC1.Nc1ccc(-c2cccs2)cc1NC(=O)c1ccc2c(c1)CC(=O)N2CCN1CCCCC1.Nc1ccc(-c2cccs2)cc1NC(=O)c1ccc2c(c1)N=CC2.
What is the InChIKey of N-[2-amino-5-(furan-2-yl)phenyl]-1-methyl-2-oxo-3H-indole-5-carboxamide;[4-[4-amino-3-[(1-methyl-2-oxo-3H-indole-5-carbonyl)amino]phenyl]phenyl] methanesulfonate;N-(2-amino-5-phenylphenyl)-1-(2-morpholin-4-ylethyl)benzimidazole-5-carboxamide;N-(2-amino-5-phenylphenyl)-3-(2-morpholin-4-ylethyl)benzimidazole-5-carboxamide;N-(2-amino-5-thiophen-2-ylphenyl)-3,3-difluoro-1-methyl-2-oxoindole-5-carboxamide;N-(2-amino-5-thiophen-2-ylphenyl)-3H-indole-6-carboxamide;N-(2-amino-5-thiophen-2-ylphenyl)-1-(3-morpholin-4-ylpropyl)-2-oxo-3H-indole-5-carboxamide;N-(2-amino-5-thiophen-2-ylphenyl)-2-oxo-1-(2-piperidin-1-ylethyl)-3H-indole-5-carboxamide?
The InChIKey is LNJPWBFBQUNVER-UHFFFAOYSA-N. The full InChI is InChI=1S/2C26H27N5O2.C26H28N4O3S.C26H28N4O2S.C23H21N3O5S.C20H15F2N3O2S.C20H17N3O3.C19H15N3OS/c27-22-8-6-20(19-4-2-1-3-5-19)16-23(22)29-26(32)21-7-9-25-24(17-21)28-18-31(25)11-10-30-12-14-33-15-13-30;27-22-8-6-20(19-4-2-1-3-5-19)16-24(22)29-26(32)21-7-9-23-25(17-21)31(18-28-23)11-10-30-12-14-33-15-13-30;27-21-6-4-18(24-3-1-14-34-24)16-22(21)28-26(32)19-5-7-23-20(15-19)17-25(31)30(23)9-2-8-29-10-12-33-13-11-29;27-21-8-6-18(24-5-4-14-33-24)16-22(21)28-26(32)19-7-9-23-20(15-19)17-25(31)30(23)13-12-29-10-2-1-3-11-29;1-26-21-10-6-16(11-17(21)13-22(26)27)23(28)25-20-12-15(5-9-19(20)24)14-3-7-18(8-4-14)31-32(2,29)30;1-25-16-7-5-12(9-13(16)20(21,22)19(25)27)18(26)24-15-10-11(4-6-14(15)23)17-3-2-8-28-17;1-23-17-7-5-13(9-14(17)11-19(23)24)20(25)22-16-10-12(4-6-15(16)21)18-3-2-8-26-18;20-15-6-5-13(18-2-1-9-24-18)10-17(15)22-19(23)14-4-3-12-7-8-21-16(12)11-14/h2*1-9,16-18H,10-15,27H2,(H,29,32);1,3-7,14-16H,2,8-13,17,27H2,(H,28,32);4-9,14-16H,1-3,10-13,17,27H2,(H,28,32);3-12H,13,24H2,1-2H3,(H,25,28);2-10H,23H2,1H3,(H,24,26);2-10H,11,21H2,1H3,(H,22,25);1-6,8-11H,7,20H2,(H,22,23).
What are the key properties of N-[2-amino-5-(furan-2-yl)phenyl]-1-methyl-2-oxo-3H-indole-5-carboxamide;[4-[4-amino-3-[(1-methyl-2-oxo-3H-indole-5-carbonyl)amino]phenyl]phenyl] methanesulfonate;N-(2-amino-5-phenylphenyl)-1-(2-morpholin-4-ylethyl)benzimidazole-5-carboxamide;N-(2-amino-5-phenylphenyl)-3-(2-morpholin-4-ylethyl)benzimidazole-5-carboxamide;N-(2-amino-5-thiophen-2-ylphenyl)-3,3-difluoro-1-methyl-2-oxoindole-5-carboxamide;N-(2-amino-5-thiophen-2-ylphenyl)-3H-indole-6-carboxamide;N-(2-amino-5-thiophen-2-ylphenyl)-1-(3-morpholin-4-ylpropyl)-2-oxo-3H-indole-5-carboxamide;N-(2-amino-5-thiophen-2-ylphenyl)-2-oxo-1-(2-piperidin-1-ylethyl)-3H-indole-5-carboxamide?
N-[2-amino-5-(furan-2-yl)phenyl]-1-methyl-2-oxo-3H-indole-5-carboxamide;[4-[4-amino-3-[(1-methyl-2-oxo-3H-indole-5-carbonyl)amino]phenyl]phenyl] methanesulfonate;N-(2-amino-5-phenylphenyl)-1-(2-morpholin-4-ylethyl)benzimidazole-5-carboxamide;N-(2-amino-5-phenylphenyl)-3-(2-morpholin-4-ylethyl)benzimidazole-5-carboxamide;N-(2-amino-5-thiophen-2-ylphenyl)-3,3-difluoro-1-methyl-2-oxoindole-5-carboxamide;N-(2-amino-5-thiophen-2-ylphenyl)-3H-indole-6-carboxamide;N-(2-amino-5-thiophen-2-ylphenyl)-1-(3-morpholin-4-ylpropyl)-2-oxo-3H-indole-5-carboxamide;N-(2-amino-5-thiophen-2-ylphenyl)-2-oxo-1-(2-piperidin-1-ylethyl)-3H-indole-5-carboxamide has a molecular weight of 3351.99 g/mol, XLogP of 31.40, 39 rotatable bonds, 16 hydrogen bond donors, and 41 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-amino-5-(furan-2-yl)phenyl]-1-methyl-2-oxo-3H-indole-5-carboxamide;[4-[4-amino-3-[(1-methyl-2-oxo-3H-indole-5-carbonyl)amino]phenyl]phenyl] methanesulfonate;N-(2-amino-5-phenylphenyl)-1-(2-morpholin-4-ylethyl)benzimidazole-5-carboxamide;N-(2-amino-5-phenylphenyl)-3-(2-morpholin-4-ylethyl)benzimidazole-5-carboxamide;N-(2-amino-5-thiophen-2-ylphenyl)-3,3-difluoro-1-methyl-2-oxoindole-5-carboxamide;N-(2-amino-5-thiophen-2-ylphenyl)-3H-indole-6-carboxamide;N-(2-amino-5-thiophen-2-ylphenyl)-1-(3-morpholin-4-ylpropyl)-2-oxo-3H-indole-5-carboxamide;N-(2-amino-5-thiophen-2-ylphenyl)-2-oxo-1-(2-piperidin-1-ylethyl)-3H-indole-5-carboxamide is sourced from PubChem (CID 163747803), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).