1-(4-fluorophenyl)-N-[(3-methylsulfonylphenyl)methyl]pyrrolo[2,3-c]pyridine-4-carboxamide;3-(4-fluorophenyl)-N-[(1S)-1-(5-methylsulfonyl-3-pyridinyl)butyl]imidazo[1,5-a]pyrazine-8-carboxamide;1-(4-fluorophenyl)-N-[(2-methylsulfonyl-4-pyridinyl)methyl]pyrrolo[2,3-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[(1S)-1-(2-methylsulfonyl-4-pyridinyl)propyl]pyrrolo[2,3-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[(1S)-1-(6-methylsulfonyl-3-pyridinyl)propyl]pyrrolo[2,3-c]pyridine-4-carboxamide

C112H99F5N20O15S5 — CID 162155639

IUPAC1-(4-fluorophenyl)-N-[(3-methylsulfonylphenyl)methyl]pyrrolo[2,3-c]pyridine-4-carboxamide;3-(4-fluorophenyl)-N-[(1S)-1-(5-methylsulfonyl-3-pyridinyl)butyl]imidazo[1,5-a]pyrazine-8-carboxamide;1-(4-fluorophenyl)-N-[(2-methylsulfonyl-4-pyridinyl)methyl]pyrrolo[2,3-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[(1S)-1-(2-methylsulfonyl-4-pyridinyl)propyl]pyrrolo[2,3-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[(1S)-1-(6-methylsulfonyl-3-pyridinyl)propyl]pyrrolo[2,3-c]pyridine-4-carboxamide
SMILESCCC[C@H](NC(=O)c1nccn2c(-c3ccc(F)cc3)ncc12)c1cncc(S(C)(=O)=O)c1.CC[C@H](NC(=O)c1cncc2c1ccn2-c1ccc(F)cc1)c1ccc(S(C)(=O)=O)nc1.CC[C@H](NC(=O)c1cncc2c1ccn2-c1ccc(F)cc1)c1ccnc(S(C)(=O)=O)c1.CS(=O)(=O)c1cc(CNC(=O)c2cncc3c2ccn3-c2ccc(F)cc2)ccn1.CS(=O)(=O)c1cccc(CNC(=O)c2cncc3c2ccn3-c2ccc(F)cc2)c1
InChIInChI=1S/C23H22FN5O3S.2C23H21FN4O3S.C22H18FN3O3S.C21H17FN4O3S/c1-3-4-19(16-11-18(13-25-12-16)33(2,31)32)28-23(30)21-20-14-27-22(29(20)10-9-26-21)15-5-7-17(24)8-6-15;1-3-20(15-4-9-22(26-12-15)32(2,30)31)27-23(29)19-13-25-14-21-18(19)10-11-28(21)17-7-5-16(24)6-8-17;1-3-20(15-8-10-26-22(12-15)32(2,30)31)27-23(29)19-13-25-14-21-18(19)9-11-28(21)17-6-4-16(24)5-7-17;1-30(28,29)18-4-2-3-15(11-18)12-25-22(27)20-13-24-14-21-19(20)9-10-26(21)17-7-5-16(23)6-8-17;1-30(28,29)20-10-14(6-8-24-20)11-25-21(27)18-12-23-13-19-17(18)7-9-26(19)16-4-2-15(22)3-5-16/h5-14,19H,3-4H2,1-2H3,(H,28,30);2*4-14,20H,3H2,1-2H3,(H,27,29);2-11,13-14H,12H2,1H3,(H,25,27);2-10,12-13H,11H2,1H3,(H,25,27)/t19-;2*20-;;/m000../s1
InChIKeyZLUCJWYRRHGBIV-KBRGHQTASA-N
MW2220.47 g/mol
LogP17.68
Rot. Bonds29

About 1-(4-fluorophenyl)-N-[(3-methylsulfonylphenyl)methyl]pyrrolo[2,3-c]pyridine-4-carboxamide;3-(4-fluorophenyl)-N-[(1S)-1-(5-methylsulfonyl-3-pyridinyl)butyl]imidazo[1,5-a]pyrazine-8-carboxamide;1-(4-fluorophenyl)-N-[(2-methylsulfonyl-4-pyridinyl)methyl]pyrrolo[2,3-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[(1S)-1-(2-methylsulfonyl-4-pyridinyl)propyl]pyrrolo[2,3-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[(1S)-1-(6-methylsulfonyl-3-pyridinyl)propyl]pyrrolo[2,3-c]pyridine-4-carboxamide

1-(4-fluorophenyl)-N-[(3-methylsulfonylphenyl)methyl]pyrrolo[2,3-c]pyridine-4-carboxamide;3-(4-fluorophenyl)-N-[(1S)-1-(5-methylsulfonyl-3-pyridinyl)butyl]imidazo[1,5-a]pyrazine-8-carboxamide;1-(4-fluorophenyl)-N-[(2-methylsulfonyl-4-pyridinyl)methyl]pyrrolo[2,3-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[(1S)-1-(2-methylsulfonyl-4-pyridinyl)propyl]pyrrolo[2,3-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[(1S)-1-(6-methylsulfonyl-3-pyridinyl)propyl]pyrrolo[2,3-c]pyridine-4-carboxamide (PubChem CID 162155639) has the molecular formula C112H99F5N20O15S5 and a molecular weight of 2220.47 g/mol. Its IUPAC name is 1-(4-fluorophenyl)-N-[(3-methylsulfonylphenyl)methyl]pyrrolo[2,3-c]pyridine-4-carboxamide;3-(4-fluorophenyl)-N-[(1S)-1-(5-methylsulfonyl-3-pyridinyl)butyl]imidazo[1,5-a]pyrazine-8-carboxamide;1-(4-fluorophenyl)-N-[(2-methylsulfonyl-4-pyridinyl)methyl]pyrrolo[2,3-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[(1S)-1-(2-methylsulfonyl-4-pyridinyl)propyl]pyrrolo[2,3-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[(1S)-1-(6-methylsulfonyl-3-pyridinyl)propyl]pyrrolo[2,3-c]pyridine-4-carboxamide.

Molecular Properties

Compound Name1-(4-fluorophenyl)-N-[(3-methylsulfonylphenyl)methyl]pyrrolo[2,3-c]pyridine-4-carboxamide;3-(4-fluorophenyl)-N-[(1S)-1-(5-methylsulfonyl-3-pyridinyl)butyl]imidazo[1,5-a]pyrazine-8-carboxamide;1-(4-fluorophenyl)-N-[(2-methylsulfonyl-4-pyridinyl)methyl]pyrrolo[2,3-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[(1S)-1-(2-methylsulfonyl-4-pyridinyl)propyl]pyrrolo[2,3-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[(1S)-1-(6-methylsulfonyl-3-pyridinyl)propyl]pyrrolo[2,3-c]pyridine-4-carboxamide
PubChem CID162155639
Molecular FormulaC112H99F5N20O15S5
Molecular Weight2220.47 g/mol
Exact Mass2218.61
IUPAC Name1-(4-fluorophenyl)-N-[(3-methylsulfonylphenyl)methyl]pyrrolo[2,3-c]pyridine-4-carboxamide;3-(4-fluorophenyl)-N-[(1S)-1-(5-methylsulfonyl-3-pyridinyl)butyl]imidazo[1,5-a]pyrazine-8-carboxamide;1-(4-fluorophenyl)-N-[(2-methylsulfonyl-4-pyridinyl)methyl]pyrrolo[2,3-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[(1S)-1-(2-methylsulfonyl-4-pyridinyl)propyl]pyrrolo[2,3-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[(1S)-1-(6-methylsulfonyl-3-pyridinyl)propyl]pyrrolo[2,3-c]pyridine-4-carboxamide
SMILESCCC[C@H](NC(=O)c1nccn2c(-c3ccc(F)cc3)ncc12)c1cncc(S(C)(=O)=O)c1.CC[C@H](NC(=O)c1cncc2c1ccn2-c1ccc(F)cc1)c1ccc(S(C)(=O)=O)nc1.CC[C@H](NC(=O)c1cncc2c1ccn2-c1ccc(F)cc1)c1ccnc(S(C)(=O)=O)c1.CS(=O)(=O)c1cc(CNC(=O)c2cncc3c2ccn3-c2ccc(F)cc2)ccn1.CS(=O)(=O)c1cccc(CNC(=O)c2cncc3c2ccn3-c2ccc(F)cc2)c1
InChIInChI=1S/C23H22FN5O3S.2C23H21FN4O3S.C22H18FN3O3S.C21H17FN4O3S/c1-3-4-19(16-11-18(13-25-12-16)33(2,31)32)28-23(30)21-20-14-27-22(29(20)10-9-26-21)15-5-7-17(24)8-6-15;1-3-20(15-4-9-22(26-12-15)32(2,30)31)27-23(29)19-13-25-14-21-18(19)10-11-28(21)17-7-5-16(24)6-8-17;1-3-20(15-8-10-26-22(12-15)32(2,30)31)27-23(29)19-13-25-14-21-18(19)9-11-28(21)17-6-4-16(24)5-7-17;1-30(28,29)18-4-2-3-15(11-18)12-25-22(27)20-13-24-14-21-19(20)9-10-26(21)17-7-5-16(23)6-8-17;1-30(28,29)20-10-14(6-8-24-20)11-25-21(27)18-12-23-13-19-17(18)7-9-26(19)16-4-2-15(22)3-5-16/h5-14,19H,3-4H2,1-2H3,(H,28,30);2*4-14,20H,3H2,1-2H3,(H,27,29);2-11,13-14H,12H2,1H3,(H,25,27);2-10,12-13H,11H2,1H3,(H,25,27)/t19-;2*20-;;/m000../s1
InChIKeyZLUCJWYRRHGBIV-KBRGHQTASA-N
XLogP17.68
TPSA469.23 Ų
H-Bond Donors5
H-Bond Acceptors30
Rotatable Bonds29
Heavy Atoms157
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002220.47
LogP ≤ 517.68
H-Bond Donors ≤ 55
H-Bond Acceptors ≤ 1030

Analyze 1-(4-fluorophenyl)-N-[(3-methylsulfonylphenyl)methyl]pyrrolo[2,3-c]pyridine-4-carboxamide;3-(4-fluorophenyl)-N-[(1S)-1-(5-methylsulfonyl-3-pyridinyl)butyl]imidazo[1,5-a]pyrazine-8-carboxamide;1-(4-fluorophenyl)-N-[(2-methylsulfonyl-4-pyridinyl)methyl]pyrrolo[2,3-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[(1S)-1-(2-methylsulfonyl-4-pyridinyl)propyl]pyrrolo[2,3-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[(1S)-1-(6-methylsulfonyl-3-pyridinyl)propyl]pyrrolo[2,3-c]pyridine-4-carboxamide with MolForge

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Related Compounds

5-(benzenesulfinyl)-4-[[4-(1,1-difluoroethyl)phenyl]methyl]-8,11,11-trimethyl-1,4,8,10-tetrazatricyclo[7.3.0.02,6]dodeca-2,5,9-trien-7-one;5-(benzenesulfonyl)-4-[[4-(1,1-difluoroethyl)phenyl]methyl]-3,8,11,11-tetramethyl-1,4,8,10-tetrazatricyclo[7.3.0.02,6]dodeca-2,5,9-triene-7-thione;5-(benzenesulfonyl)-4-[[4-(1,1-difluoroethyl)phenyl]methyl]-8,11,11-trimethyl-1,4,8,10-tetrazatricyclo[7.3.0.02,6]dodeca-2,5,9-trien-7-one;4-[[4-(1,1-difluoroethyl)phenyl]methyl]-8,11-dimethyl-5-phenylsulfanyl-1,4,8,10-tetrazatricyclo[7.3.0.02,6]dodeca-2,5,9-trien-7-one;4-[[4-(1,1-difluoroethyl)phenyl]methyl]-3,8,11,11-tetramethyl-7-methylimino-N-phenyl-1,4,8,10-tetrazatricyclo[7.3.0.02,6]dodeca-2,5,9-trien-5-amine
CID 157254125
N-[[3,5-bis(trifluoromethyl)phenyl]methyl]-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide;N-[[6-(cyclopropanecarbonylamino)-3-pyridinyl]methyl]-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[[2-(3-hydroxypropylsulfonyl)-4-pyridinyl]methyl]pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[[6-(2-methylpropanoylamino)-3-pyridinyl]methyl]pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[[3-methylsulfonyl-5-(trifluoromethyl)phenyl]methyl]pyrazolo[5,4-c]pyridine-4-carboxamide
CID 159079721
3-[[5-(4-aminopyrido[3,4-d]pyrimidin-6-yl)thiophen-2-yl]methylamino]-N-[(1S)-1-(4-fluoro-3-methylphenyl)ethyl]pyrazine-2-carboxamide;3-[[5-(4-aminoquinazolin-6-yl)thiophen-2-yl]methylamino]-N-[(1S)-1-(4-fluoro-3-methylphenyl)ethyl]pyrazine-2-carboxamide;5-[[5-(4-aminoquinazolin-6-yl)thiophen-2-yl]methylamino]-3-[(1S)-1-(4-fluoro-3-methylphenyl)ethyl]pyrido[4,3-d]pyrimidin-4-one;N-[(1S)-1-(4-fluoro-3-methylphenyl)ethyl]-2-[[5-(1-methylimidazo[4,5-c]quinolin-8-yl)thiophen-2-yl]methylamino]-5-(trifluoromethyl)pyridine-3-carboxamide;N-[(4-fluoro-3-methylphenyl)methyl]-2-[[5-(1-methylimidazo[4,5-c]quinolin-8-yl)thiophen-2-yl]methylamino]pyridine-3-carboxamide;2-[[5-(1-methylimidazo[4,5-c]quinolin-8-yl)thiophen-2-yl]methylamino]-N-[(1S)-1-(4-methylphenyl)ethyl]pyridine-3-carboxamide
CID 159275399
1-(4-fluorophenyl)-N-[(1S)-1-(2-methylsulfonyl-4-pyridinyl)ethyl]pyrazolo[3,4-d]pyridazine-4-carboxamide;1-(4-fluorophenyl)-N-[(2-methylsulfonyl-4-pyridinyl)methyl]pyrazolo[3,4-d]pyridazine-4-carboxamide;1-(4-fluorophenyl)-N-[(1S)-1-(2-methylsulfonyl-4-pyridinyl)propyl]pyrazolo[3,4-d]pyridazine-4-carboxamide;1-(4-fluorophenyl)-N-[(1S)-1-(6-methylsulfonyl-3-pyridinyl)propyl]pyrazolo[3,4-d]pyridazine-4-carboxamide;1-(4-fluorophenyl)-N-[[3-(trifluoromethyl)phenyl]methyl]pyrazolo[3,4-d]pyrimidine-4-carboxamide
CID 159322771
3-[[5-(4-aminopyrido[3,4-d]pyrimidin-6-yl)thiophen-2-yl]methylamino]-N-[(1S)-1-(3-fluoro-4-methylphenyl)ethyl]pyrazine-2-carboxamide;3-[[5-(4-aminoquinazolin-6-yl)thiophen-2-yl]methylamino]-N-[(1S)-1-(3-fluoro-4-methylphenyl)ethyl]pyrazine-2-carboxamide;5-[[5-(4-aminoquinazolin-6-yl)thiophen-2-yl]methylamino]-3-[(1S)-1-(3-fluoro-4-methylphenyl)ethyl]pyrido[4,3-d]pyrimidin-4-one;N-[(1S)-1-(3-fluoro-4-methylphenyl)ethyl]-2-[[5-(1-methylimidazo[4,5-c]quinolin-8-yl)thiophen-2-yl]methylamino]-5-(trifluoromethyl)pyridine-3-carboxamide;N-[(3-fluoro-4-methylphenyl)methyl]-2-[[5-(1-methylimidazo[4,5-c]quinolin-8-yl)thiophen-2-yl]methylamino]pyridine-3-carboxamide;2-[[5-(1-methylimidazo[4,5-c]quinolin-8-yl)thiophen-2-yl]methylamino]-N-[(1S)-1-(4-methylphenyl)ethyl]pyridine-3-carboxamide
CID 159972431
5-anilino-4-[[4-(1,1-difluoroethyl)phenyl]methyl]-3,8-dimethyl-1,4,8,10-tetrazatetracyclo[7.6.0.02,6.011,15]pentadeca-2,5,9-trien-7-one;(11R,15S)-5-anilino-8-methyl-4-[(4-pyridin-2-ylphenyl)methyl]-1,4,8,10-tetrazatetracyclo[7.6.0.02,6.011,15]pentadeca-2,5,9-trien-7-one;5-(benzenesulfonyl)-4-[[4-(1,1-difluoroethyl)phenyl]methyl]-3,8,11,11-tetramethyl-1,4,8,10-tetrazatricyclo[7.3.0.02,6]dodeca-2,5,9-triene-7-thione;5-(benzenesulfonyl)-4-[[4-(1,1-difluoroethyl)phenyl]methyl]-8,11,11-trimethyl-1,4,8,10-tetrazatricyclo[7.3.0.02,6]dodeca-2,5,9-trien-7-one;4-[[4-(1,1-difluoroethyl)phenyl]methyl]-3,8,11,11-tetramethyl-7-methylimino-N-phenyl-1,4,8,10-tetrazatricyclo[7.3.0.02,6]dodeca-2,5,9-trien-5-amine
CID 160087135
6-(3-cyano-6-fluoro-5-methyl-1-pyrazin-2-ylindol-2-yl)-N-[(2S)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;6-(3-cyano-6-fluoro-5-methyl-1-pyridin-2-ylindol-2-yl)-N-[(2S)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;6-[3-cyano-1-(4-fluorophenyl)-5-methylindol-2-yl]-N-[(2S)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;6-(3-cyano-5-methyl-1-phenylindol-2-yl)-N-[(2S)-1,1,1-trifluoropropan-2-yl]pyridine-3-sulfonamide;6-fluoro-5-methyl-1-pyrimidin-2-yl-2-[5-[[(2S)-1,1,1-trifluoropropan-2-yl]sulfamoyl]-2-pyridinyl]indole-3-carboxamide;5-methyl-1-pyrazin-2-yl-2-[5-[[(2S)-1,1,1-trifluoropropan-2-yl]sulfamoyl]-2-pyridinyl]indole-3-carboxamide
CID 160506398
2-[4-[5-Cyclopropyl-3-methyl-4-oxo-6-(trifluoromethyl)imidazo[4,5-c]pyridin-2-yl]-3-ethylsulfonylphenyl]-2-methylpropanenitrile;2-[6-[7-(difluoromethylsulfanyl)imidazo[1,2-c]pyrimidin-2-yl]-5-ethylsulfonyl-3-pyridinyl]-2-methylpropanenitrile;2-[6-[7-(difluoromethylsulfonyl)imidazo[1,2-c]pyrimidin-2-yl]-5-ethylsulfonyl-3-pyridinyl]-2-methylpropanenitrile;2-[4-[5-ethyl-3-methyl-4-oxo-6-(trifluoromethyl)imidazo[4,5-c]pyridin-2-yl]-3-ethylsulfonylphenyl]-2-methylpropanenitrile;2-[5-ethylsulfanyl-6-[3-methyl-4-oxo-5-(2,2,2-trifluoroethyl)-6-(trifluoromethyl)imidazo[4,5-c]pyridin-2-yl]-3-pyridinyl]-2-methylpropanenitrile;2-[5-ethylsulfonyl-6-[3-methyl-4-oxo-5-(2,2,2-trifluoroethyl)-6-(trifluoromethyl)imidazo[4,5-c]pyridin-2-yl]-3-pyridinyl]-2-methylpropanenitrile;2-[5-ethylsulfonyl-6-[7-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]-3-pyridinyl]-2-methylpropanenitrile
CID 160748747
N-[[3,5-bis(trifluoromethyl)phenyl]methyl]-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide;N-[[6-(cyclopropanecarbonylamino)-3-pyridinyl]methyl]-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide;N-[[6-[2-(dimethylamino)ethyl-methylsulfonylamino]-3-pyridinyl]methyl]-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[[2-(3-hydroxypropylsulfonyl)-4-pyridinyl]methyl]pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[[3-methylsulfonyl-5-(trifluoromethyl)phenyl]methyl]pyrazolo[5,4-c]pyridine-4-carboxamide
CID 160893913
3-[[2-(1H-indol-3-yl)-5H-pyrrolo[3,2-d]pyrimidin-4-yl]amino]-4-methyl-N-[3-(trifluoromethyl)phenyl]benzamide;4-methyl-N-phenyl-3-[(2-pyridin-3-yl-5H-pyrrolo[3,2-d]pyrimidin-4-yl)amino]benzamide;1-[4-methyl-3-[(2-pyridin-3-yl-5H-pyrrolo[3,2-d]pyrimidin-4-yl)amino]phenyl]-3-[3-(trifluoromethyl)phenyl]propane-2-thione;1-[4-methyl-3-[(2-pyridin-3-yl-5H-pyrrolo[3,2-d]pyrimidin-4-yl)amino]phenyl]-3-[3-(trifluoromethyl)phenyl]propan-2-one;N-[2-methyl-5-[[3-(trifluoromethyl)phenyl]sulfonylmethyl]phenyl]-2-pyridin-3-yl-5H-pyrrolo[3,2-d]pyrimidin-4-amine
CID 161025385
8-[[4-(Benzenesulfonyl)-1,3-thiazol-5-yl]methyl]-6-(2-methylcyclopenten-1-yl)-2-(4-piperidin-3-ylanilino)pyrido[2,3-d]pyrimidin-7-one;8-[[5-[2-(dimethylamino)ethylsulfonyl]-1,3-thiazol-4-yl]methyl]-6-(1-methylimidazol-2-yl)-2-[4-(1-methylpyrrolidin-3-yl)anilino]pyrido[2,3-d]pyrimidin-7-one;8-[(2-fluoro-6-pyridin-4-ylsulfinylphenyl)methyl]-6-(2-methylphenyl)-2-(4-piperazin-1-ylanilino)pyrido[2,3-d]pyrimidin-7-one;6-(pyridin-3-ylamino)-2-[4-(pyrrolidin-3-ylamino)anilino]-8-[[1-(2,2,2-trifluoroethylsulfonyl)pyrrol-2-yl]methyl]pyrido[2,3-d]pyrimidin-7-one
CID 161663489
4-amino-N-[5-[[4-(4-fluorophenyl)-2-methylsulfonyl-1H-imidazole-5-carbonyl]amino]-2-methylphenyl]thieno[3,2-d]pyrimidine-7-carboxamide;N-[5-[[2-(1,1-difluoroethyl)-4-(4-fluorophenyl)-1H-imidazole-5-carbonyl]amino]-2-methylphenyl]-1H-pyrrolo[2,3-b]pyridine-3-carboxamide;4-(4-fluorophenyl)-N-[4-methyl-3-[(3-methyl-4-oxoquinazolin-8-yl)amino]phenyl]-2-methylsulfonyl-1H-imidazole-5-carboxamide;5-(4-fluorophenyl)-1-methyl-N-[4-methyl-3-[(4-pyridin-3-ylpyrimidin-2-yl)amino]phenyl]-2-methylsulfonylimidazole-4-carboxamide
CID 161884361

Frequently Asked Questions

What is the IUPAC name of 1-(4-fluorophenyl)-N-[(3-methylsulfonylphenyl)methyl]pyrrolo[2,3-c]pyridine-4-carboxamide;3-(4-fluorophenyl)-N-[(1S)-1-(5-methylsulfonyl-3-pyridinyl)butyl]imidazo[1,5-a]pyrazine-8-carboxamide;1-(4-fluorophenyl)-N-[(2-methylsulfonyl-4-pyridinyl)methyl]pyrrolo[2,3-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[(1S)-1-(2-methylsulfonyl-4-pyridinyl)propyl]pyrrolo[2,3-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[(1S)-1-(6-methylsulfonyl-3-pyridinyl)propyl]pyrrolo[2,3-c]pyridine-4-carboxamide?
The IUPAC name of 1-(4-fluorophenyl)-N-[(3-methylsulfonylphenyl)methyl]pyrrolo[2,3-c]pyridine-4-carboxamide;3-(4-fluorophenyl)-N-[(1S)-1-(5-methylsulfonyl-3-pyridinyl)butyl]imidazo[1,5-a]pyrazine-8-carboxamide;1-(4-fluorophenyl)-N-[(2-methylsulfonyl-4-pyridinyl)methyl]pyrrolo[2,3-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[(1S)-1-(2-methylsulfonyl-4-pyridinyl)propyl]pyrrolo[2,3-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[(1S)-1-(6-methylsulfonyl-3-pyridinyl)propyl]pyrrolo[2,3-c]pyridine-4-carboxamide (CID 162155639) is 1-(4-fluorophenyl)-N-[(3-methylsulfonylphenyl)methyl]pyrrolo[2,3-c]pyridine-4-carboxamide;3-(4-fluorophenyl)-N-[(1S)-1-(5-methylsulfonyl-3-pyridinyl)butyl]imidazo[1,5-a]pyrazine-8-carboxamide;1-(4-fluorophenyl)-N-[(2-methylsulfonyl-4-pyridinyl)methyl]pyrrolo[2,3-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[(1S)-1-(2-methylsulfonyl-4-pyridinyl)propyl]pyrrolo[2,3-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[(1S)-1-(6-methylsulfonyl-3-pyridinyl)propyl]pyrrolo[2,3-c]pyridine-4-carboxamide.
What is the SMILES notation for 1-(4-fluorophenyl)-N-[(3-methylsulfonylphenyl)methyl]pyrrolo[2,3-c]pyridine-4-carboxamide;3-(4-fluorophenyl)-N-[(1S)-1-(5-methylsulfonyl-3-pyridinyl)butyl]imidazo[1,5-a]pyrazine-8-carboxamide;1-(4-fluorophenyl)-N-[(2-methylsulfonyl-4-pyridinyl)methyl]pyrrolo[2,3-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[(1S)-1-(2-methylsulfonyl-4-pyridinyl)propyl]pyrrolo[2,3-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[(1S)-1-(6-methylsulfonyl-3-pyridinyl)propyl]pyrrolo[2,3-c]pyridine-4-carboxamide?
The canonical SMILES for 1-(4-fluorophenyl)-N-[(3-methylsulfonylphenyl)methyl]pyrrolo[2,3-c]pyridine-4-carboxamide;3-(4-fluorophenyl)-N-[(1S)-1-(5-methylsulfonyl-3-pyridinyl)butyl]imidazo[1,5-a]pyrazine-8-carboxamide;1-(4-fluorophenyl)-N-[(2-methylsulfonyl-4-pyridinyl)methyl]pyrrolo[2,3-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[(1S)-1-(2-methylsulfonyl-4-pyridinyl)propyl]pyrrolo[2,3-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[(1S)-1-(6-methylsulfonyl-3-pyridinyl)propyl]pyrrolo[2,3-c]pyridine-4-carboxamide is CCC[C@H](NC(=O)c1nccn2c(-c3ccc(F)cc3)ncc12)c1cncc(S(C)(=O)=O)c1.CC[C@H](NC(=O)c1cncc2c1ccn2-c1ccc(F)cc1)c1ccc(S(C)(=O)=O)nc1.CC[C@H](NC(=O)c1cncc2c1ccn2-c1ccc(F)cc1)c1ccnc(S(C)(=O)=O)c1.CS(=O)(=O)c1cc(CNC(=O)c2cncc3c2ccn3-c2ccc(F)cc2)ccn1.CS(=O)(=O)c1cccc(CNC(=O)c2cncc3c2ccn3-c2ccc(F)cc2)c1.
What is the InChIKey of 1-(4-fluorophenyl)-N-[(3-methylsulfonylphenyl)methyl]pyrrolo[2,3-c]pyridine-4-carboxamide;3-(4-fluorophenyl)-N-[(1S)-1-(5-methylsulfonyl-3-pyridinyl)butyl]imidazo[1,5-a]pyrazine-8-carboxamide;1-(4-fluorophenyl)-N-[(2-methylsulfonyl-4-pyridinyl)methyl]pyrrolo[2,3-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[(1S)-1-(2-methylsulfonyl-4-pyridinyl)propyl]pyrrolo[2,3-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[(1S)-1-(6-methylsulfonyl-3-pyridinyl)propyl]pyrrolo[2,3-c]pyridine-4-carboxamide?
The InChIKey is ZLUCJWYRRHGBIV-KBRGHQTASA-N. The full InChI is InChI=1S/C23H22FN5O3S.2C23H21FN4O3S.C22H18FN3O3S.C21H17FN4O3S/c1-3-4-19(16-11-18(13-25-12-16)33(2,31)32)28-23(30)21-20-14-27-22(29(20)10-9-26-21)15-5-7-17(24)8-6-15;1-3-20(15-4-9-22(26-12-15)32(2,30)31)27-23(29)19-13-25-14-21-18(19)10-11-28(21)17-7-5-16(24)6-8-17;1-3-20(15-8-10-26-22(12-15)32(2,30)31)27-23(29)19-13-25-14-21-18(19)9-11-28(21)17-6-4-16(24)5-7-17;1-30(28,29)18-4-2-3-15(11-18)12-25-22(27)20-13-24-14-21-19(20)9-10-26(21)17-7-5-16(23)6-8-17;1-30(28,29)20-10-14(6-8-24-20)11-25-21(27)18-12-23-13-19-17(18)7-9-26(19)16-4-2-15(22)3-5-16/h5-14,19H,3-4H2,1-2H3,(H,28,30);2*4-14,20H,3H2,1-2H3,(H,27,29);2-11,13-14H,12H2,1H3,(H,25,27);2-10,12-13H,11H2,1H3,(H,25,27)/t19-;2*20-;;/m000../s1.
What are the key properties of 1-(4-fluorophenyl)-N-[(3-methylsulfonylphenyl)methyl]pyrrolo[2,3-c]pyridine-4-carboxamide;3-(4-fluorophenyl)-N-[(1S)-1-(5-methylsulfonyl-3-pyridinyl)butyl]imidazo[1,5-a]pyrazine-8-carboxamide;1-(4-fluorophenyl)-N-[(2-methylsulfonyl-4-pyridinyl)methyl]pyrrolo[2,3-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[(1S)-1-(2-methylsulfonyl-4-pyridinyl)propyl]pyrrolo[2,3-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[(1S)-1-(6-methylsulfonyl-3-pyridinyl)propyl]pyrrolo[2,3-c]pyridine-4-carboxamide?
1-(4-fluorophenyl)-N-[(3-methylsulfonylphenyl)methyl]pyrrolo[2,3-c]pyridine-4-carboxamide;3-(4-fluorophenyl)-N-[(1S)-1-(5-methylsulfonyl-3-pyridinyl)butyl]imidazo[1,5-a]pyrazine-8-carboxamide;1-(4-fluorophenyl)-N-[(2-methylsulfonyl-4-pyridinyl)methyl]pyrrolo[2,3-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[(1S)-1-(2-methylsulfonyl-4-pyridinyl)propyl]pyrrolo[2,3-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[(1S)-1-(6-methylsulfonyl-3-pyridinyl)propyl]pyrrolo[2,3-c]pyridine-4-carboxamide has a molecular weight of 2220.47 g/mol, XLogP of 17.68, 29 rotatable bonds, 5 hydrogen bond donors, and 30 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-fluorophenyl)-N-[(3-methylsulfonylphenyl)methyl]pyrrolo[2,3-c]pyridine-4-carboxamide;3-(4-fluorophenyl)-N-[(1S)-1-(5-methylsulfonyl-3-pyridinyl)butyl]imidazo[1,5-a]pyrazine-8-carboxamide;1-(4-fluorophenyl)-N-[(2-methylsulfonyl-4-pyridinyl)methyl]pyrrolo[2,3-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[(1S)-1-(2-methylsulfonyl-4-pyridinyl)propyl]pyrrolo[2,3-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[(1S)-1-(6-methylsulfonyl-3-pyridinyl)propyl]pyrrolo[2,3-c]pyridine-4-carboxamide is sourced from PubChem (CID 162155639), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).