3-(2-aminopropan-2-yl)-N-[4-methyl-3-(1,3,3-trimethyl-2-oxopyrrolo[2,3-b]pyridin-5-yl)phenyl]-5-(trifluoromethyl)benzamide;2-(2-fluoropropan-2-yl)-N-[3-[6-(2-hydroxypropan-2-yl)-5-morpholin-4-yl-3-pyridinyl]-4-methylphenyl]pyridine-4-carboxamide;N-[4-methyl-3-[2-morpholin-4-yl-6-[[(2R)-pyrrolidin-2-yl]methoxy]-4-pyridinyl]phenyl]-2-(trifluoromethyl)pyridine-4-carboxamide;N-[4-methyl-3-[2-morpholin-4-yl-6-[[(2R)-pyrrolidin-2-yl]methoxy]-4-pyridinyl]phenyl]-4-(trifluoromethyl)pyridine-2-carboxamide;N-[4-methyl-3-[2-morpholin-4-yl-6-[[(2R)-pyrrolidin-2-yl]methoxy]-4-pyridinyl]phenyl]-5-(trifluoromethyl)pyridine-3-carboxamide

C140H152F13N23O14 — CID 161016283

IUPAC3-(2-aminopropan-2-yl)-N-[4-methyl-3-(1,3,3-trimethyl-2-oxopyrrolo[2,3-b]pyridin-5-yl)phenyl]-5-(trifluoromethyl)benzamide;2-(2-fluoropropan-2-yl)-N-[3-[6-(2-hydroxypropan-2-yl)-5-morpholin-4-yl-3-pyridinyl]-4-methylphenyl]pyridine-4-carboxamide;N-[4-methyl-3-[2-morpholin-4-yl-6-[[(2R)-pyrrolidin-2-yl]methoxy]-4-pyridinyl]phenyl]-2-(trifluoromethyl)pyridine-4-carboxamide;N-[4-methyl-3-[2-morpholin-4-yl-6-[[(2R)-pyrrolidin-2-yl]methoxy]-4-pyridinyl]phenyl]-4-(trifluoromethyl)pyridine-2-carboxamide;N-[4-methyl-3-[2-morpholin-4-yl-6-[[(2R)-pyrrolidin-2-yl]methoxy]-4-pyridinyl]phenyl]-5-(trifluoromethyl)pyridine-3-carboxamide
SMILESCc1ccc(NC(=O)c2cc(C(C)(C)N)cc(C(F)(F)F)c2)cc1-c1cnc2c(c1)C(C)(C)C(=O)N2C.Cc1ccc(NC(=O)c2cc(C(F)(F)F)ccn2)cc1-c1cc(OC[C@H]2CCCN2)nc(N2CCOCC2)c1.Cc1ccc(NC(=O)c2ccnc(C(C)(C)F)c2)cc1-c1cnc(C(C)(C)O)c(N2CCOCC2)c1.Cc1ccc(NC(=O)c2ccnc(C(F)(F)F)c2)cc1-c1cc(OC[C@H]2CCCN2)nc(N2CCOCC2)c1.Cc1ccc(NC(=O)c2cncc(C(F)(F)F)c2)cc1-c1cc(OC[C@H]2CCCN2)nc(N2CCOCC2)c1
InChIInChI=1S/3C28H30F3N5O3.C28H29F3N4O2.C28H33FN4O3/c1-18-4-5-21(34-27(37)24-15-20(6-8-33-24)28(29,30)31)16-23(18)19-13-25(36-9-11-38-12-10-36)35-26(14-19)39-17-22-3-2-7-32-22;1-18-4-5-21(34-27(37)19-6-8-33-24(13-19)28(29,30)31)16-23(18)20-14-25(36-9-11-38-12-10-36)35-26(15-20)39-17-22-3-2-7-32-22;1-18-4-5-22(34-27(37)20-11-21(16-32-15-20)28(29,30)31)14-24(18)19-12-25(36-7-9-38-10-8-36)35-26(13-19)39-17-23-3-2-6-33-23;1-15-7-8-20(13-21(15)17-11-22-23(33-14-17)35(6)25(37)26(22,2)3)34-24(36)16-9-18(27(4,5)32)12-19(10-16)28(29,30)31;1-18-6-7-21(32-26(34)19-8-9-30-24(15-19)27(2,3)29)16-22(18)20-14-23(33-10-12-36-13-11-33)25(31-17-20)28(4,5)35/h2*4-6,8,13-16,22,32H,2-3,7,9-12,17H2,1H3,(H,34,37);4-5,11-16,23,33H,2-3,6-10,17H2,1H3,(H,34,37);7-14H,32H2,1-6H3,(H,34,36);6-9,14-17,35H,10-13H2,1-5H3,(H,32,34)/t2*22-;23-;;/m111../s1
InChIKeyTXTRMZWFUDFQHG-VWKQJPSRSA-N
MW2627.88 g/mol
LogP24.82
Rot. Bonds31

About 3-(2-aminopropan-2-yl)-N-[4-methyl-3-(1,3,3-trimethyl-2-oxopyrrolo[2,3-b]pyridin-5-yl)phenyl]-5-(trifluoromethyl)benzamide;2-(2-fluoropropan-2-yl)-N-[3-[6-(2-hydroxypropan-2-yl)-5-morpholin-4-yl-3-pyridinyl]-4-methylphenyl]pyridine-4-carboxamide;N-[4-methyl-3-[2-morpholin-4-yl-6-[[(2R)-pyrrolidin-2-yl]methoxy]-4-pyridinyl]phenyl]-2-(trifluoromethyl)pyridine-4-carboxamide;N-[4-methyl-3-[2-morpholin-4-yl-6-[[(2R)-pyrrolidin-2-yl]methoxy]-4-pyridinyl]phenyl]-4-(trifluoromethyl)pyridine-2-carboxamide;N-[4-methyl-3-[2-morpholin-4-yl-6-[[(2R)-pyrrolidin-2-yl]methoxy]-4-pyridinyl]phenyl]-5-(trifluoromethyl)pyridine-3-carboxamide

3-(2-aminopropan-2-yl)-N-[4-methyl-3-(1,3,3-trimethyl-2-oxopyrrolo[2,3-b]pyridin-5-yl)phenyl]-5-(trifluoromethyl)benzamide;2-(2-fluoropropan-2-yl)-N-[3-[6-(2-hydroxypropan-2-yl)-5-morpholin-4-yl-3-pyridinyl]-4-methylphenyl]pyridine-4-carboxamide;N-[4-methyl-3-[2-morpholin-4-yl-6-[[(2R)-pyrrolidin-2-yl]methoxy]-4-pyridinyl]phenyl]-2-(trifluoromethyl)pyridine-4-carboxamide;N-[4-methyl-3-[2-morpholin-4-yl-6-[[(2R)-pyrrolidin-2-yl]methoxy]-4-pyridinyl]phenyl]-4-(trifluoromethyl)pyridine-2-carboxamide;N-[4-methyl-3-[2-morpholin-4-yl-6-[[(2R)-pyrrolidin-2-yl]methoxy]-4-pyridinyl]phenyl]-5-(trifluoromethyl)pyridine-3-carboxamide (PubChem CID 161016283) has the molecular formula C140H152F13N23O14 and a molecular weight of 2627.88 g/mol. Its IUPAC name is 3-(2-aminopropan-2-yl)-N-[4-methyl-3-(1,3,3-trimethyl-2-oxopyrrolo[2,3-b]pyridin-5-yl)phenyl]-5-(trifluoromethyl)benzamide;2-(2-fluoropropan-2-yl)-N-[3-[6-(2-hydroxypropan-2-yl)-5-morpholin-4-yl-3-pyridinyl]-4-methylphenyl]pyridine-4-carboxamide;N-[4-methyl-3-[2-morpholin-4-yl-6-[[(2R)-pyrrolidin-2-yl]methoxy]-4-pyridinyl]phenyl]-2-(trifluoromethyl)pyridine-4-carboxamide;N-[4-methyl-3-[2-morpholin-4-yl-6-[[(2R)-pyrrolidin-2-yl]methoxy]-4-pyridinyl]phenyl]-4-(trifluoromethyl)pyridine-2-carboxamide;N-[4-methyl-3-[2-morpholin-4-yl-6-[[(2R)-pyrrolidin-2-yl]methoxy]-4-pyridinyl]phenyl]-5-(trifluoromethyl)pyridine-3-carboxamide.

Molecular Properties

Compound Name3-(2-aminopropan-2-yl)-N-[4-methyl-3-(1,3,3-trimethyl-2-oxopyrrolo[2,3-b]pyridin-5-yl)phenyl]-5-(trifluoromethyl)benzamide;2-(2-fluoropropan-2-yl)-N-[3-[6-(2-hydroxypropan-2-yl)-5-morpholin-4-yl-3-pyridinyl]-4-methylphenyl]pyridine-4-carboxamide;N-[4-methyl-3-[2-morpholin-4-yl-6-[[(2R)-pyrrolidin-2-yl]methoxy]-4-pyridinyl]phenyl]-2-(trifluoromethyl)pyridine-4-carboxamide;N-[4-methyl-3-[2-morpholin-4-yl-6-[[(2R)-pyrrolidin-2-yl]methoxy]-4-pyridinyl]phenyl]-4-(trifluoromethyl)pyridine-2-carboxamide;N-[4-methyl-3-[2-morpholin-4-yl-6-[[(2R)-pyrrolidin-2-yl]methoxy]-4-pyridinyl]phenyl]-5-(trifluoromethyl)pyridine-3-carboxamide
PubChem CID161016283
Molecular FormulaC140H152F13N23O14
Molecular Weight2627.88 g/mol
Exact Mass2626.17
IUPAC Name3-(2-aminopropan-2-yl)-N-[4-methyl-3-(1,3,3-trimethyl-2-oxopyrrolo[2,3-b]pyridin-5-yl)phenyl]-5-(trifluoromethyl)benzamide;2-(2-fluoropropan-2-yl)-N-[3-[6-(2-hydroxypropan-2-yl)-5-morpholin-4-yl-3-pyridinyl]-4-methylphenyl]pyridine-4-carboxamide;N-[4-methyl-3-[2-morpholin-4-yl-6-[[(2R)-pyrrolidin-2-yl]methoxy]-4-pyridinyl]phenyl]-2-(trifluoromethyl)pyridine-4-carboxamide;N-[4-methyl-3-[2-morpholin-4-yl-6-[[(2R)-pyrrolidin-2-yl]methoxy]-4-pyridinyl]phenyl]-4-(trifluoromethyl)pyridine-2-carboxamide;N-[4-methyl-3-[2-morpholin-4-yl-6-[[(2R)-pyrrolidin-2-yl]methoxy]-4-pyridinyl]phenyl]-5-(trifluoromethyl)pyridine-3-carboxamide
SMILESCc1ccc(NC(=O)c2cc(C(C)(C)N)cc(C(F)(F)F)c2)cc1-c1cnc2c(c1)C(C)(C)C(=O)N2C.Cc1ccc(NC(=O)c2cc(C(F)(F)F)ccn2)cc1-c1cc(OC[C@H]2CCCN2)nc(N2CCOCC2)c1.Cc1ccc(NC(=O)c2ccnc(C(C)(C)F)c2)cc1-c1cnc(C(C)(C)O)c(N2CCOCC2)c1.Cc1ccc(NC(=O)c2ccnc(C(F)(F)F)c2)cc1-c1cc(OC[C@H]2CCCN2)nc(N2CCOCC2)c1.Cc1ccc(NC(=O)c2cncc(C(F)(F)F)c2)cc1-c1cc(OC[C@H]2CCCN2)nc(N2CCOCC2)c1
InChIInChI=1S/3C28H30F3N5O3.C28H29F3N4O2.C28H33FN4O3/c1-18-4-5-21(34-27(37)24-15-20(6-8-33-24)28(29,30)31)16-23(18)19-13-25(36-9-11-38-12-10-36)35-26(14-19)39-17-22-3-2-7-32-22;1-18-4-5-21(34-27(37)19-6-8-33-24(13-19)28(29,30)31)16-23(18)20-14-25(36-9-11-38-12-10-36)35-26(15-20)39-17-22-3-2-7-32-22;1-18-4-5-22(34-27(37)20-11-21(16-32-15-20)28(29,30)31)14-24(18)19-12-25(36-7-9-38-10-8-36)35-26(13-19)39-17-23-3-2-6-33-23;1-15-7-8-20(13-21(15)17-11-22-23(33-14-17)35(6)25(37)26(22,2)3)34-24(36)16-9-18(27(4,5)32)12-19(10-16)28(29,30)31;1-18-6-7-21(32-26(34)19-8-9-30-24(15-19)27(2,3)29)16-22(18)20-14-23(33-10-12-36-13-11-33)25(31-17-20)28(4,5)35/h2*4-6,8,13-16,22,32H,2-3,7,9-12,17H2,1H3,(H,34,37);4-5,11-16,23,33H,2-3,6-10,17H2,1H3,(H,34,37);7-14H,32H2,1-6H3,(H,34,36);6-9,14-17,35H,10-13H2,1-5H3,(H,32,34)/t2*22-;23-;;/m111../s1
InChIKeyTXTRMZWFUDFQHG-VWKQJPSRSA-N
XLogP24.82
TPSA441.73 Ų
H-Bond Donors10
H-Bond Acceptors31
Rotatable Bonds31
Heavy Atoms190
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002627.88
LogP ≤ 524.82
H-Bond Donors ≤ 510
H-Bond Acceptors ≤ 1031

Analyze 3-(2-aminopropan-2-yl)-N-[4-methyl-3-(1,3,3-trimethyl-2-oxopyrrolo[2,3-b]pyridin-5-yl)phenyl]-5-(trifluoromethyl)benzamide;2-(2-fluoropropan-2-yl)-N-[3-[6-(2-hydroxypropan-2-yl)-5-morpholin-4-yl-3-pyridinyl]-4-methylphenyl]pyridine-4-carboxamide;N-[4-methyl-3-[2-morpholin-4-yl-6-[[(2R)-pyrrolidin-2-yl]methoxy]-4-pyridinyl]phenyl]-2-(trifluoromethyl)pyridine-4-carboxamide;N-[4-methyl-3-[2-morpholin-4-yl-6-[[(2R)-pyrrolidin-2-yl]methoxy]-4-pyridinyl]phenyl]-4-(trifluoromethyl)pyridine-2-carboxamide;N-[4-methyl-3-[2-morpholin-4-yl-6-[[(2R)-pyrrolidin-2-yl]methoxy]-4-pyridinyl]phenyl]-5-(trifluoromethyl)pyridine-3-carboxamide 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

N-[4-methyl-3-[2-[2-[(2S)-4-[4-[4-[2-methyl-5-[[5-(trifluoromethyl)pyridine-3-carbonyl]amino]phenyl]-6-[[(2S)-pyrrolidin-2-yl]methoxy]pyridin-2-yl]morpholin-3-yl]pyrrolidin-2-yl]ethoxy]-6-morpholin-4-ylpyridin-4-yl]phenyl]-4-(trifluoromethyl)pyridine-2-carboxamide
CID 130425780
(2S,4R)-N-[8-[5-[[3-acetyl-1-[2-[(2S,4R)-4-fluoro-2-[(5-phenylmethoxy-2-pyridinyl)carbamoyl]pyrrolidin-1-yl]-2-oxoethyl]indol-5-yl]amino]pyrimidin-2-yl]naphthalen-2-yl]-1-[2-[3-acetyl-5-(pyrimidin-5-ylamino)indol-1-yl]acetyl]-4-fluoropyrrolidine-2-carboxamide
CID 144912177
7-[[5-[4-[7-fluoro-3-[7-[[5-[(3R,4R)-4-fluoro-3-hydroxypiperidin-1-yl]-2-pyridinyl]amino]-1-oxo-2,3-dihydroisoindol-4-yl]imidazo[1,2-a]pyridin-8-yl]oxy-4-(morpholin-4-ylmethyl)piperidin-1-yl]-2-pyridinyl]amino]-4-(7-fluoroimidazo[1,2-a]pyridin-3-yl)-2,3-dihydroisoindol-1-one
CID 156166587
N-[6-[4-[(2-fluorophenyl)carbamoyl]-2-methylphenyl]-3-pyridinyl]-2-(4-phenylpiperidin-1-yl)-4-(trifluoromethyl)-1,3-oxazole-5-carboxamide;N-[6-[(2S)-4-[(2-fluorophenyl)carbamoyl]-2-methylpiperazin-1-yl]-3-pyridinyl]-2-(3-methylpiperidin-1-yl)-4-(trifluoromethyl)-1,3-oxazole-5-carboxamide;N-[6-[(3R)-4-[(2-fluorophenyl)carbamoyl]-3-methylpiperazin-1-yl]-3-pyridinyl]-2-(4-phenylpiperidin-1-yl)-4-(trifluoromethyl)-1,3-oxazole-5-carboxamide;N-[5-[4-[(2-fluorophenyl)carbamoyl]piperazin-1-yl]-2-pyridinyl]-2-(3-methylpiperidin-1-yl)-4-(trifluoromethyl)-1,3-oxazole-5-carboxamide;N-[6-[(3R)-1-[(2-fluorophenyl)carbamoyl]pyrrolidin-3-yl]oxy-3-pyridinyl]-2-(3-methylpiperidin-1-yl)-4-(trifluoromethyl)-1,3-oxazole-5-carboxamide
CID 157066680
(Z)-3-(4-aminophenyl)-N-[[5-[5-[(3R)-3-fluoro-3-methylpyrrolidine-1-carbonyl]-2-pyridinyl]-7-(trifluoromethyl)-1-benzofuran-2-yl]methyl]prop-2-enamide;(E)-3-(6-amino-3-pyridinyl)-N-[[5-[5-[(3R)-3-fluoro-3-methylpyrrolidine-1-carbonyl]-2-pyridinyl]-7-(trifluoromethyl)-1-benzofuran-2-yl]methyl]prop-2-enamide;(Z)-3-(6-amino-3-pyridinyl)-N-[[5-[5-[(3S)-3-fluoro-3-methylpyrrolidine-1-carbonyl]-2-pyridinyl]-7-(trifluoromethyl)-1-benzofuran-2-yl]methyl]prop-2-enamide;(E)-3-(6-amino-3-pyridinyl)-N-[[5-[5-[(3S)-3-fluoro-3-methylpyrrolidine-1-carbonyl]-2-pyridinyl]-7-(trifluoromethyl)-1-benzofuran-2-yl]methyl]prop-2-enamide
CID 157153475
(9S)-N-[3-[2-[(1-aminoethylideneamino)methyl]-1,3-oxazol-5-yl]phenyl]-5-[3-(trifluoromethyl)phenyl]-1,6,8-triazatricyclo[7.2.1.02,7]dodeca-2(7),3,5-triene-8-carboxamide;(9S)-N-[4-(3-aminopropyl)-3-(1,3-oxazol-5-yl)phenyl]-5-[3-(1,1-difluoroethyl)phenyl]-1,6,8-triazatricyclo[7.2.1.02,7]dodeca-2(7),3,5-triene-8-carboxamide;(9S)-5-[3-(1,1-difluoroethyl)phenyl]-3-methoxy-N-pyridin-2-yl-1,6,8-triazatricyclo[7.2.1.02,7]dodeca-2(7),3,5-triene-8-carboxamide;(9S)-N-pyrazin-2-yl-5-[3-(trifluoromethyl)phenyl]-1,6,8-triazatricyclo[7.2.1.02,7]dodeca-2(7),3,5-triene-8-carboxamide
CID 157340465
2-(2-fluoropropan-2-yl)-N-[6-methyl-5-(1-methyl-7-morpholin-4-ylpyrazolo[4,5-d]pyrimidin-5-yl)-3-pyridinyl]pyridine-4-carboxamide;2-(2-fluoropropan-2-yl)-N-[4-methyl-3-[2-morpholin-4-yl-6-[[(2S)-pyrrolidin-2-yl]methoxy]-4-pyridinyl]phenyl]pyridine-4-carboxamide;N-[6-methyl-5-(1-methyl-7-morpholin-4-ylpyrazolo[4,5-d]pyrimidin-5-yl)-3-pyridinyl]-2-(trifluoromethyl)pyridine-4-carboxamide;N-[4-methyl-3-[2-morpholin-4-yl-6-[[(2S)-pyrrolidin-2-yl]methoxy]-4-pyridinyl]phenyl]-4-(trifluoromethyl)pyridine-2-carboxamide;N-[4-methyl-3-[2-morpholin-4-yl-6-[[(2S)-pyrrolidin-2-yl]methoxy]-4-pyridinyl]phenyl]-5-(trifluoromethyl)pyridine-3-carboxamide
CID 157812885
CID 157881525
CID 157881525
12-[(4,4-difluoropiperidin-1-yl)methyl]-4-(1H-indol-4-yl)-6-morpholin-4-yl-8-oxa-3,5,10-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;12-[(4-fluoropiperidin-1-yl)methyl]-4-(1H-indol-4-yl)-6-morpholin-4-yl-8-oxa-3,5,10-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;4-(1H-indol-4-yl)-6,12-dimorpholin-4-yl-8-oxa-3,5,10-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;4-(1H-indol-4-yl)-11-methyl-6-morpholin-4-yl-8-oxa-3,5,10-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene
CID 158180516
(9S)-N-[3-[2-[(1-aminoethylideneamino)methyl]-1,3-oxazol-5-yl]phenyl]-5-[3-(trifluoromethyl)phenyl]-1,6,8-triazatricyclo[7.2.1.02,7]dodeca-2(7),3,5-triene-8-carboxamide;(9S)-N-[4-(3-aminopropyl)-3-(1,3-oxazol-5-yl)phenyl]-5-[3-(1,1-difluoroethyl)phenyl]-1,6,8-triazatricyclo[7.2.1.02,7]dodeca-2(7),3,5-triene-8-carboxamide;(9S)-5-[3-(1,1-difluoroethyl)phenyl]-3-methoxy-N-pyridin-2-yl-1,6,8-triazatricyclo[7.2.1.02,7]dodeca-2(7),3,5-triene-8-carboxamide;(9S)-N-pyrazin-2-yl-5-[5-(trifluoromethyl)-3-pyridinyl]-1,6,8-triazatricyclo[7.2.1.02,7]dodeca-2(7),3,5-triene-8-carboxamide
CID 158606723
N-[5-[6-(4-deuteriooxan-4-yl)oxy-5-morpholin-4-yl-3-pyridinyl]-6-methyl-3-pyridinyl]-3-(trifluoromethyl)benzamide;3-(1,1-difluoro-2-hydroxyethyl)-N-[4-methyl-3-[5-morpholin-4-yl-6-(oxan-4-yloxy)-3-pyridinyl]phenyl]benzamide;2-(difluoromethyl)-N-[4-methyl-3-[2-morpholin-4-yl-6-(oxan-4-yloxy)-4-pyridinyl]phenyl]pyridine-4-carboxamide;2-(2-hydroxypropan-2-yl)-N-[4-methyl-3-[2-morpholin-4-yl-6-(oxan-4-yloxy)-4-pyridinyl]phenyl]pyridine-4-carboxamide
CID 158776131
5-(3,3-dimethyl-2-oxo-1-pyridin-2-ylpyrrolo[2,3-b]pyridin-4-yl)-N-(3-fluoro-4-methylphenyl)-2-(trifluoromethyl)pyridine-3-carboxamide;5-(3,3-dimethyl-2-oxo-1-pyrimidin-2-ylindol-4-yl)-N-(4-methylphenyl)-2-(trifluoromethoxy)benzamide;6-(3,3-dimethyl-2-oxo-1-pyrimidin-2-ylindol-4-yl)-N-(4-methylphenyl)-3-(trifluoromethyl)pyridine-2-carboxamide
CID 158799862

Frequently Asked Questions

What is the IUPAC name of 3-(2-aminopropan-2-yl)-N-[4-methyl-3-(1,3,3-trimethyl-2-oxopyrrolo[2,3-b]pyridin-5-yl)phenyl]-5-(trifluoromethyl)benzamide;2-(2-fluoropropan-2-yl)-N-[3-[6-(2-hydroxypropan-2-yl)-5-morpholin-4-yl-3-pyridinyl]-4-methylphenyl]pyridine-4-carboxamide;N-[4-methyl-3-[2-morpholin-4-yl-6-[[(2R)-pyrrolidin-2-yl]methoxy]-4-pyridinyl]phenyl]-2-(trifluoromethyl)pyridine-4-carboxamide;N-[4-methyl-3-[2-morpholin-4-yl-6-[[(2R)-pyrrolidin-2-yl]methoxy]-4-pyridinyl]phenyl]-4-(trifluoromethyl)pyridine-2-carboxamide;N-[4-methyl-3-[2-morpholin-4-yl-6-[[(2R)-pyrrolidin-2-yl]methoxy]-4-pyridinyl]phenyl]-5-(trifluoromethyl)pyridine-3-carboxamide?
The IUPAC name of 3-(2-aminopropan-2-yl)-N-[4-methyl-3-(1,3,3-trimethyl-2-oxopyrrolo[2,3-b]pyridin-5-yl)phenyl]-5-(trifluoromethyl)benzamide;2-(2-fluoropropan-2-yl)-N-[3-[6-(2-hydroxypropan-2-yl)-5-morpholin-4-yl-3-pyridinyl]-4-methylphenyl]pyridine-4-carboxamide;N-[4-methyl-3-[2-morpholin-4-yl-6-[[(2R)-pyrrolidin-2-yl]methoxy]-4-pyridinyl]phenyl]-2-(trifluoromethyl)pyridine-4-carboxamide;N-[4-methyl-3-[2-morpholin-4-yl-6-[[(2R)-pyrrolidin-2-yl]methoxy]-4-pyridinyl]phenyl]-4-(trifluoromethyl)pyridine-2-carboxamide;N-[4-methyl-3-[2-morpholin-4-yl-6-[[(2R)-pyrrolidin-2-yl]methoxy]-4-pyridinyl]phenyl]-5-(trifluoromethyl)pyridine-3-carboxamide (CID 161016283) is 3-(2-aminopropan-2-yl)-N-[4-methyl-3-(1,3,3-trimethyl-2-oxopyrrolo[2,3-b]pyridin-5-yl)phenyl]-5-(trifluoromethyl)benzamide;2-(2-fluoropropan-2-yl)-N-[3-[6-(2-hydroxypropan-2-yl)-5-morpholin-4-yl-3-pyridinyl]-4-methylphenyl]pyridine-4-carboxamide;N-[4-methyl-3-[2-morpholin-4-yl-6-[[(2R)-pyrrolidin-2-yl]methoxy]-4-pyridinyl]phenyl]-2-(trifluoromethyl)pyridine-4-carboxamide;N-[4-methyl-3-[2-morpholin-4-yl-6-[[(2R)-pyrrolidin-2-yl]methoxy]-4-pyridinyl]phenyl]-4-(trifluoromethyl)pyridine-2-carboxamide;N-[4-methyl-3-[2-morpholin-4-yl-6-[[(2R)-pyrrolidin-2-yl]methoxy]-4-pyridinyl]phenyl]-5-(trifluoromethyl)pyridine-3-carboxamide.
What is the SMILES notation for 3-(2-aminopropan-2-yl)-N-[4-methyl-3-(1,3,3-trimethyl-2-oxopyrrolo[2,3-b]pyridin-5-yl)phenyl]-5-(trifluoromethyl)benzamide;2-(2-fluoropropan-2-yl)-N-[3-[6-(2-hydroxypropan-2-yl)-5-morpholin-4-yl-3-pyridinyl]-4-methylphenyl]pyridine-4-carboxamide;N-[4-methyl-3-[2-morpholin-4-yl-6-[[(2R)-pyrrolidin-2-yl]methoxy]-4-pyridinyl]phenyl]-2-(trifluoromethyl)pyridine-4-carboxamide;N-[4-methyl-3-[2-morpholin-4-yl-6-[[(2R)-pyrrolidin-2-yl]methoxy]-4-pyridinyl]phenyl]-4-(trifluoromethyl)pyridine-2-carboxamide;N-[4-methyl-3-[2-morpholin-4-yl-6-[[(2R)-pyrrolidin-2-yl]methoxy]-4-pyridinyl]phenyl]-5-(trifluoromethyl)pyridine-3-carboxamide?
The canonical SMILES for 3-(2-aminopropan-2-yl)-N-[4-methyl-3-(1,3,3-trimethyl-2-oxopyrrolo[2,3-b]pyridin-5-yl)phenyl]-5-(trifluoromethyl)benzamide;2-(2-fluoropropan-2-yl)-N-[3-[6-(2-hydroxypropan-2-yl)-5-morpholin-4-yl-3-pyridinyl]-4-methylphenyl]pyridine-4-carboxamide;N-[4-methyl-3-[2-morpholin-4-yl-6-[[(2R)-pyrrolidin-2-yl]methoxy]-4-pyridinyl]phenyl]-2-(trifluoromethyl)pyridine-4-carboxamide;N-[4-methyl-3-[2-morpholin-4-yl-6-[[(2R)-pyrrolidin-2-yl]methoxy]-4-pyridinyl]phenyl]-4-(trifluoromethyl)pyridine-2-carboxamide;N-[4-methyl-3-[2-morpholin-4-yl-6-[[(2R)-pyrrolidin-2-yl]methoxy]-4-pyridinyl]phenyl]-5-(trifluoromethyl)pyridine-3-carboxamide is Cc1ccc(NC(=O)c2cc(C(C)(C)N)cc(C(F)(F)F)c2)cc1-c1cnc2c(c1)C(C)(C)C(=O)N2C.Cc1ccc(NC(=O)c2cc(C(F)(F)F)ccn2)cc1-c1cc(OC[C@H]2CCCN2)nc(N2CCOCC2)c1.Cc1ccc(NC(=O)c2ccnc(C(C)(C)F)c2)cc1-c1cnc(C(C)(C)O)c(N2CCOCC2)c1.Cc1ccc(NC(=O)c2ccnc(C(F)(F)F)c2)cc1-c1cc(OC[C@H]2CCCN2)nc(N2CCOCC2)c1.Cc1ccc(NC(=O)c2cncc(C(F)(F)F)c2)cc1-c1cc(OC[C@H]2CCCN2)nc(N2CCOCC2)c1.
What is the InChIKey of 3-(2-aminopropan-2-yl)-N-[4-methyl-3-(1,3,3-trimethyl-2-oxopyrrolo[2,3-b]pyridin-5-yl)phenyl]-5-(trifluoromethyl)benzamide;2-(2-fluoropropan-2-yl)-N-[3-[6-(2-hydroxypropan-2-yl)-5-morpholin-4-yl-3-pyridinyl]-4-methylphenyl]pyridine-4-carboxamide;N-[4-methyl-3-[2-morpholin-4-yl-6-[[(2R)-pyrrolidin-2-yl]methoxy]-4-pyridinyl]phenyl]-2-(trifluoromethyl)pyridine-4-carboxamide;N-[4-methyl-3-[2-morpholin-4-yl-6-[[(2R)-pyrrolidin-2-yl]methoxy]-4-pyridinyl]phenyl]-4-(trifluoromethyl)pyridine-2-carboxamide;N-[4-methyl-3-[2-morpholin-4-yl-6-[[(2R)-pyrrolidin-2-yl]methoxy]-4-pyridinyl]phenyl]-5-(trifluoromethyl)pyridine-3-carboxamide?
The InChIKey is TXTRMZWFUDFQHG-VWKQJPSRSA-N. The full InChI is InChI=1S/3C28H30F3N5O3.C28H29F3N4O2.C28H33FN4O3/c1-18-4-5-21(34-27(37)24-15-20(6-8-33-24)28(29,30)31)16-23(18)19-13-25(36-9-11-38-12-10-36)35-26(14-19)39-17-22-3-2-7-32-22;1-18-4-5-21(34-27(37)19-6-8-33-24(13-19)28(29,30)31)16-23(18)20-14-25(36-9-11-38-12-10-36)35-26(15-20)39-17-22-3-2-7-32-22;1-18-4-5-22(34-27(37)20-11-21(16-32-15-20)28(29,30)31)14-24(18)19-12-25(36-7-9-38-10-8-36)35-26(13-19)39-17-23-3-2-6-33-23;1-15-7-8-20(13-21(15)17-11-22-23(33-14-17)35(6)25(37)26(22,2)3)34-24(36)16-9-18(27(4,5)32)12-19(10-16)28(29,30)31;1-18-6-7-21(32-26(34)19-8-9-30-24(15-19)27(2,3)29)16-22(18)20-14-23(33-10-12-36-13-11-33)25(31-17-20)28(4,5)35/h2*4-6,8,13-16,22,32H,2-3,7,9-12,17H2,1H3,(H,34,37);4-5,11-16,23,33H,2-3,6-10,17H2,1H3,(H,34,37);7-14H,32H2,1-6H3,(H,34,36);6-9,14-17,35H,10-13H2,1-5H3,(H,32,34)/t2*22-;23-;;/m111../s1.
What are the key properties of 3-(2-aminopropan-2-yl)-N-[4-methyl-3-(1,3,3-trimethyl-2-oxopyrrolo[2,3-b]pyridin-5-yl)phenyl]-5-(trifluoromethyl)benzamide;2-(2-fluoropropan-2-yl)-N-[3-[6-(2-hydroxypropan-2-yl)-5-morpholin-4-yl-3-pyridinyl]-4-methylphenyl]pyridine-4-carboxamide;N-[4-methyl-3-[2-morpholin-4-yl-6-[[(2R)-pyrrolidin-2-yl]methoxy]-4-pyridinyl]phenyl]-2-(trifluoromethyl)pyridine-4-carboxamide;N-[4-methyl-3-[2-morpholin-4-yl-6-[[(2R)-pyrrolidin-2-yl]methoxy]-4-pyridinyl]phenyl]-4-(trifluoromethyl)pyridine-2-carboxamide;N-[4-methyl-3-[2-morpholin-4-yl-6-[[(2R)-pyrrolidin-2-yl]methoxy]-4-pyridinyl]phenyl]-5-(trifluoromethyl)pyridine-3-carboxamide?
3-(2-aminopropan-2-yl)-N-[4-methyl-3-(1,3,3-trimethyl-2-oxopyrrolo[2,3-b]pyridin-5-yl)phenyl]-5-(trifluoromethyl)benzamide;2-(2-fluoropropan-2-yl)-N-[3-[6-(2-hydroxypropan-2-yl)-5-morpholin-4-yl-3-pyridinyl]-4-methylphenyl]pyridine-4-carboxamide;N-[4-methyl-3-[2-morpholin-4-yl-6-[[(2R)-pyrrolidin-2-yl]methoxy]-4-pyridinyl]phenyl]-2-(trifluoromethyl)pyridine-4-carboxamide;N-[4-methyl-3-[2-morpholin-4-yl-6-[[(2R)-pyrrolidin-2-yl]methoxy]-4-pyridinyl]phenyl]-4-(trifluoromethyl)pyridine-2-carboxamide;N-[4-methyl-3-[2-morpholin-4-yl-6-[[(2R)-pyrrolidin-2-yl]methoxy]-4-pyridinyl]phenyl]-5-(trifluoromethyl)pyridine-3-carboxamide has a molecular weight of 2627.88 g/mol, XLogP of 24.82, 31 rotatable bonds, 10 hydrogen bond donors, and 31 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-aminopropan-2-yl)-N-[4-methyl-3-(1,3,3-trimethyl-2-oxopyrrolo[2,3-b]pyridin-5-yl)phenyl]-5-(trifluoromethyl)benzamide;2-(2-fluoropropan-2-yl)-N-[3-[6-(2-hydroxypropan-2-yl)-5-morpholin-4-yl-3-pyridinyl]-4-methylphenyl]pyridine-4-carboxamide;N-[4-methyl-3-[2-morpholin-4-yl-6-[[(2R)-pyrrolidin-2-yl]methoxy]-4-pyridinyl]phenyl]-2-(trifluoromethyl)pyridine-4-carboxamide;N-[4-methyl-3-[2-morpholin-4-yl-6-[[(2R)-pyrrolidin-2-yl]methoxy]-4-pyridinyl]phenyl]-4-(trifluoromethyl)pyridine-2-carboxamide;N-[4-methyl-3-[2-morpholin-4-yl-6-[[(2R)-pyrrolidin-2-yl]methoxy]-4-pyridinyl]phenyl]-5-(trifluoromethyl)pyridine-3-carboxamide is sourced from PubChem (CID 161016283), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).