(2R)-N-(3-chloro-4-methylphenyl)-2-[4-(cyclopentylamino)phenyl]-1-(2-fluoro-6-methylbenzoyl)piperidine-3-carboxamide;(2R)-2-[4-(cyclopentylamino)phenyl]-1-(2-fluoro-6-methylbenzoyl)-N-(3-methyl-1H-inden-5-yl)piperidine-3-carboxamide;2-[4-(cyclopentylamino)phenyl]-1-(2-fluoro-6-methylbenzoyl)-3-methyl-N-[4-methyl-3-(trifluoromethyl)phenyl]piperidine-3-carboxamide;(2R)-2-(4-cyclopentyloxyphenyl)-1-(2-fluoro-6-methylbenzoyl)-N-[4-methyl-3-(trifluoromethyl)phenyl]piperidine-3-carboxamide;(2R)-1-(2-fluoro-6-methylbenzoyl)-2-[4-[(2-methylcyclopentyl)amino]phenyl]-N-[4-methyl-3-(trifluoromethyl)phenyl]piperidine-3-carboxamide

C168H181ClF14N14O11 — CID 160911024

IUPAC(2R)-N-(3-chloro-4-methylphenyl)-2-[4-(cyclopentylamino)phenyl]-1-(2-fluoro-6-methylbenzoyl)piperidine-3-carboxamide;(2R)-2-[4-(cyclopentylamino)phenyl]-1-(2-fluoro-6-methylbenzoyl)-N-(3-methyl-1H-inden-5-yl)piperidine-3-carboxamide;2-[4-(cyclopentylamino)phenyl]-1-(2-fluoro-6-methylbenzoyl)-3-methyl-N-[4-methyl-3-(trifluoromethyl)phenyl]piperidine-3-carboxamide;(2R)-2-(4-cyclopentyloxyphenyl)-1-(2-fluoro-6-methylbenzoyl)-N-[4-methyl-3-(trifluoromethyl)phenyl]piperidine-3-carboxamide;(2R)-1-(2-fluoro-6-methylbenzoyl)-2-[4-[(2-methylcyclopentyl)amino]phenyl]-N-[4-methyl-3-(trifluoromethyl)phenyl]piperidine-3-carboxamide
SMILESCC1=CCc2ccc(NC(=O)C3CCCN(C(=O)c4c(C)cccc4F)[C@H]3c3ccc(NC4CCCC4)cc3)cc21.Cc1ccc(NC(=O)C2(C)CCCN(C(=O)c3c(C)cccc3F)C2c2ccc(NC3CCCC3)cc2)cc1C(F)(F)F.Cc1ccc(NC(=O)C2CCCN(C(=O)c3c(C)cccc3F)C2c2ccc(NC3CCCC3)cc2)cc1Cl.Cc1ccc(NC(=O)C2CCCN(C(=O)c3c(C)cccc3F)[C@H]2c2ccc(NC3CCCC3C)cc2)cc1C(F)(F)F.Cc1ccc(NC(=O)C2CCCN(C(=O)c3c(C)cccc3F)[C@H]2c2ccc(OC3CCCC3)cc2)cc1C(F)(F)F
InChIInChI=1S/C35H38FN3O2.2C34H37F4N3O2.C33H34F4N2O3.C32H35ClFN3O2/c1-22-12-13-24-14-19-28(21-30(22)24)38-34(40)29-10-6-20-39(35(41)32-23(2)7-5-11-31(32)36)33(29)25-15-17-27(18-16-25)37-26-8-3-4-9-26;1-20-12-15-25(19-27(20)34(36,37)38)40-32(42)26-9-6-18-41(33(43)30-22(3)8-4-10-28(30)35)31(26)23-13-16-24(17-14-23)39-29-11-5-7-21(29)2;1-21-12-15-26(20-27(21)34(36,37)38)40-32(43)33(3)18-7-19-41(31(42)29-22(2)8-6-11-28(29)35)30(33)23-13-16-25(17-14-23)39-24-9-4-5-10-24;1-20-12-15-23(19-27(20)33(35,36)37)38-31(40)26-10-6-18-39(32(41)29-21(2)7-5-11-28(29)34)30(26)22-13-16-25(17-14-22)42-24-8-3-4-9-24;1-20-12-15-25(19-27(20)33)36-31(38)26-10-6-18-37(32(39)29-21(2)7-5-11-28(29)34)30(26)22-13-16-24(17-14-22)35-23-8-3-4-9-23/h5,7,11-12,14-19,21,26,29,33,37H,3-4,6,8-10,13,20H2,1-2H3,(H,38,40);4,8,10,12-17,19,21,26,29,31,39H,5-7,9,11,18H2,1-3H3,(H,40,42);6,8,11-17,20,24,30,39H,4-5,7,9-10,18-19H2,1-3H3,(H,40,43);5,7,11-17,19,24,26,30H,3-4,6,8-10,18H2,1-2H3,(H,38,40);5,7,11-17,19,23,26,30,35H,3-4,6,8-10,18H2,1-2H3,(H,36,38)/t29?,33-;21?,26?,29?,31-;;26?,30-;/m00.0./s1
InChIKeySQTXSNOXDSUFDG-LVGHCJKOSA-N
MW2873.81 g/mol
LogP40.11
Rot. Bonds30

About (2R)-N-(3-chloro-4-methylphenyl)-2-[4-(cyclopentylamino)phenyl]-1-(2-fluoro-6-methylbenzoyl)piperidine-3-carboxamide;(2R)-2-[4-(cyclopentylamino)phenyl]-1-(2-fluoro-6-methylbenzoyl)-N-(3-methyl-1H-inden-5-yl)piperidine-3-carboxamide;2-[4-(cyclopentylamino)phenyl]-1-(2-fluoro-6-methylbenzoyl)-3-methyl-N-[4-methyl-3-(trifluoromethyl)phenyl]piperidine-3-carboxamide;(2R)-2-(4-cyclopentyloxyphenyl)-1-(2-fluoro-6-methylbenzoyl)-N-[4-methyl-3-(trifluoromethyl)phenyl]piperidine-3-carboxamide;(2R)-1-(2-fluoro-6-methylbenzoyl)-2-[4-[(2-methylcyclopentyl)amino]phenyl]-N-[4-methyl-3-(trifluoromethyl)phenyl]piperidine-3-carboxamide

(2R)-N-(3-chloro-4-methylphenyl)-2-[4-(cyclopentylamino)phenyl]-1-(2-fluoro-6-methylbenzoyl)piperidine-3-carboxamide;(2R)-2-[4-(cyclopentylamino)phenyl]-1-(2-fluoro-6-methylbenzoyl)-N-(3-methyl-1H-inden-5-yl)piperidine-3-carboxamide;2-[4-(cyclopentylamino)phenyl]-1-(2-fluoro-6-methylbenzoyl)-3-methyl-N-[4-methyl-3-(trifluoromethyl)phenyl]piperidine-3-carboxamide;(2R)-2-(4-cyclopentyloxyphenyl)-1-(2-fluoro-6-methylbenzoyl)-N-[4-methyl-3-(trifluoromethyl)phenyl]piperidine-3-carboxamide;(2R)-1-(2-fluoro-6-methylbenzoyl)-2-[4-[(2-methylcyclopentyl)amino]phenyl]-N-[4-methyl-3-(trifluoromethyl)phenyl]piperidine-3-carboxamide (PubChem CID 160911024) has the molecular formula C168H181ClF14N14O11 and a molecular weight of 2873.81 g/mol. Its IUPAC name is (2R)-N-(3-chloro-4-methylphenyl)-2-[4-(cyclopentylamino)phenyl]-1-(2-fluoro-6-methylbenzoyl)piperidine-3-carboxamide;(2R)-2-[4-(cyclopentylamino)phenyl]-1-(2-fluoro-6-methylbenzoyl)-N-(3-methyl-1H-inden-5-yl)piperidine-3-carboxamide;2-[4-(cyclopentylamino)phenyl]-1-(2-fluoro-6-methylbenzoyl)-3-methyl-N-[4-methyl-3-(trifluoromethyl)phenyl]piperidine-3-carboxamide;(2R)-2-(4-cyclopentyloxyphenyl)-1-(2-fluoro-6-methylbenzoyl)-N-[4-methyl-3-(trifluoromethyl)phenyl]piperidine-3-carboxamide;(2R)-1-(2-fluoro-6-methylbenzoyl)-2-[4-[(2-methylcyclopentyl)amino]phenyl]-N-[4-methyl-3-(trifluoromethyl)phenyl]piperidine-3-carboxamide.

Molecular Properties

Compound Name(2R)-N-(3-chloro-4-methylphenyl)-2-[4-(cyclopentylamino)phenyl]-1-(2-fluoro-6-methylbenzoyl)piperidine-3-carboxamide;(2R)-2-[4-(cyclopentylamino)phenyl]-1-(2-fluoro-6-methylbenzoyl)-N-(3-methyl-1H-inden-5-yl)piperidine-3-carboxamide;2-[4-(cyclopentylamino)phenyl]-1-(2-fluoro-6-methylbenzoyl)-3-methyl-N-[4-methyl-3-(trifluoromethyl)phenyl]piperidine-3-carboxamide;(2R)-2-(4-cyclopentyloxyphenyl)-1-(2-fluoro-6-methylbenzoyl)-N-[4-methyl-3-(trifluoromethyl)phenyl]piperidine-3-carboxamide;(2R)-1-(2-fluoro-6-methylbenzoyl)-2-[4-[(2-methylcyclopentyl)amino]phenyl]-N-[4-methyl-3-(trifluoromethyl)phenyl]piperidine-3-carboxamide
PubChem CID160911024
Molecular FormulaC168H181ClF14N14O11
Molecular Weight2873.81 g/mol
Exact Mass2871.35
IUPAC Name(2R)-N-(3-chloro-4-methylphenyl)-2-[4-(cyclopentylamino)phenyl]-1-(2-fluoro-6-methylbenzoyl)piperidine-3-carboxamide;(2R)-2-[4-(cyclopentylamino)phenyl]-1-(2-fluoro-6-methylbenzoyl)-N-(3-methyl-1H-inden-5-yl)piperidine-3-carboxamide;2-[4-(cyclopentylamino)phenyl]-1-(2-fluoro-6-methylbenzoyl)-3-methyl-N-[4-methyl-3-(trifluoromethyl)phenyl]piperidine-3-carboxamide;(2R)-2-(4-cyclopentyloxyphenyl)-1-(2-fluoro-6-methylbenzoyl)-N-[4-methyl-3-(trifluoromethyl)phenyl]piperidine-3-carboxamide;(2R)-1-(2-fluoro-6-methylbenzoyl)-2-[4-[(2-methylcyclopentyl)amino]phenyl]-N-[4-methyl-3-(trifluoromethyl)phenyl]piperidine-3-carboxamide
SMILESCC1=CCc2ccc(NC(=O)C3CCCN(C(=O)c4c(C)cccc4F)[C@H]3c3ccc(NC4CCCC4)cc3)cc21.Cc1ccc(NC(=O)C2(C)CCCN(C(=O)c3c(C)cccc3F)C2c2ccc(NC3CCCC3)cc2)cc1C(F)(F)F.Cc1ccc(NC(=O)C2CCCN(C(=O)c3c(C)cccc3F)C2c2ccc(NC3CCCC3)cc2)cc1Cl.Cc1ccc(NC(=O)C2CCCN(C(=O)c3c(C)cccc3F)[C@H]2c2ccc(NC3CCCC3C)cc2)cc1C(F)(F)F.Cc1ccc(NC(=O)C2CCCN(C(=O)c3c(C)cccc3F)[C@H]2c2ccc(OC3CCCC3)cc2)cc1C(F)(F)F
InChIInChI=1S/C35H38FN3O2.2C34H37F4N3O2.C33H34F4N2O3.C32H35ClFN3O2/c1-22-12-13-24-14-19-28(21-30(22)24)38-34(40)29-10-6-20-39(35(41)32-23(2)7-5-11-31(32)36)33(29)25-15-17-27(18-16-25)37-26-8-3-4-9-26;1-20-12-15-25(19-27(20)34(36,37)38)40-32(42)26-9-6-18-41(33(43)30-22(3)8-4-10-28(30)35)31(26)23-13-16-24(17-14-23)39-29-11-5-7-21(29)2;1-21-12-15-26(20-27(21)34(36,37)38)40-32(43)33(3)18-7-19-41(31(42)29-22(2)8-6-11-28(29)35)30(33)23-13-16-25(17-14-23)39-24-9-4-5-10-24;1-20-12-15-23(19-27(20)33(35,36)37)38-31(40)26-10-6-18-39(32(41)29-21(2)7-5-11-28(29)34)30(26)22-13-16-25(17-14-22)42-24-8-3-4-9-24;1-20-12-15-25(19-27(20)33)36-31(38)26-10-6-18-37(32(39)29-21(2)7-5-11-28(29)34)30(26)22-13-16-24(17-14-22)35-23-8-3-4-9-23/h5,7,11-12,14-19,21,26,29,33,37H,3-4,6,8-10,13,20H2,1-2H3,(H,38,40);4,8,10,12-17,19,21,26,29,31,39H,5-7,9,11,18H2,1-3H3,(H,40,42);6,8,11-17,20,24,30,39H,4-5,7,9-10,18-19H2,1-3H3,(H,40,43);5,7,11-17,19,24,26,30H,3-4,6,8-10,18H2,1-2H3,(H,38,40);5,7,11-17,19,23,26,30,35H,3-4,6,8-10,18H2,1-2H3,(H,36,38)/t29?,33-;21?,26?,29?,31-;;26?,30-;/m00.0./s1
InChIKeySQTXSNOXDSUFDG-LVGHCJKOSA-N
XLogP40.11
TPSA304.40 Ų
H-Bond Donors9
H-Bond Acceptors15
Rotatable Bonds30
Heavy Atoms208
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002873.81
LogP ≤ 540.11
H-Bond Donors ≤ 59
H-Bond Acceptors ≤ 1015

Analyze (2R)-N-(3-chloro-4-methylphenyl)-2-[4-(cyclopentylamino)phenyl]-1-(2-fluoro-6-methylbenzoyl)piperidine-3-carboxamide;(2R)-2-[4-(cyclopentylamino)phenyl]-1-(2-fluoro-6-methylbenzoyl)-N-(3-methyl-1H-inden-5-yl)piperidine-3-carboxamide;2-[4-(cyclopentylamino)phenyl]-1-(2-fluoro-6-methylbenzoyl)-3-methyl-N-[4-methyl-3-(trifluoromethyl)phenyl]piperidine-3-carboxamide;(2R)-2-(4-cyclopentyloxyphenyl)-1-(2-fluoro-6-methylbenzoyl)-N-[4-methyl-3-(trifluoromethyl)phenyl]piperidine-3-carboxamide;(2R)-1-(2-fluoro-6-methylbenzoyl)-2-[4-[(2-methylcyclopentyl)amino]phenyl]-N-[4-methyl-3-(trifluoromethyl)phenyl]piperidine-3-carboxamide with MolForge

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Related Compounds

(2R,3S)-N-(3-chloro-4-methylphenyl)-2-[4-(cyclopentylamino)phenyl]-1-(2-fluoro-6-methylbenzoyl)piperidine-3-carboxamide;(2R,3S)-2-[4-(cyclopentylamino)phenyl]-1-(2-fluoro-6-methylbenzoyl)-N-(3-methyl-1H-inden-5-yl)piperidine-3-carboxamide;(2R,3S)-2-(4-cyclopentyloxyphenyl)-1-(2-fluoro-6-methylbenzoyl)-N-[4-methyl-3-(trifluoromethyl)phenyl]piperidine-3-carboxamide;(2R,3S)-1-(2-fluoro-6-methylbenzoyl)-2-[4-[(2-methylcyclopentyl)amino]phenyl]-N-[4-methyl-3-(trifluoromethyl)phenyl]piperidine-3-carboxamide
CID 157507731
(2R,3S)-N-(3-tert-butylphenyl)-1-(2-methylbenzoyl)-2-[4-[[(2S)-2-methylpyrrolidin-1-yl]methyl]phenyl]piperidine-3-carboxamide;(2R,3S)-1-(2-chlorobenzoyl)-N-(3-chloro-4-methylphenyl)-2-[4-(cyclopentylamino)phenyl]piperidine-3-carboxamide;(2R,3S)-2-(4-cyclopentyloxyphenyl)-1-(2-fluoro-6-methylbenzoyl)-N-[4-methyl-3-(trifluoromethyl)phenyl]piperidine-3-carboxamide;(2R,3S)-1-(2-fluoro-6-methylbenzoyl)-2-[4-[(2-methylcyclopentyl)amino]phenyl]-N-[4-methyl-3-(trifluoromethyl)phenyl]piperidine-3-carboxamide
CID 158949244
(2S,3S)-N-(3-tert-butylphenyl)-2-cyclopropyl-1-(2-methylbenzoyl)piperidine-3-carboxamide;(2R,3S)-N-(3-tert-butylphenyl)-1-(2,6-dimethylbenzoyl)-2-(4-methoxyphenyl)piperidine-3-carboxamide;(2R,3S)-N-(3-tert-butylphenyl)-2-(4-methoxyphenyl)-1-(2-methylbenzoyl)piperidine-3-carboxamide;(2S,3S)-2-cyclohexyl-1-(2,6-difluorobenzoyl)-N-(2,3-dihydro-1H-inden-5-yl)piperidine-3-carboxamide;(2R,3S)-N-(2,3-dihydro-1H-inden-5-yl)-2-phenyl-1-[2-(trifluoromethyl)benzoyl]piperidine-3-carboxamide
CID 159353976
N-(3-chlorophenyl)-3-methyl-4-[3-[(3'R)-3'-methylspiro[indene-1,4'-piperidine]-1'-yl]cyclopentyl]benzamide;N-cyclohexyl-3-methyl-4-[3-[(3'R)-3'-methylspiro[indene-1,4'-piperidine]-1'-yl]cyclopentyl]benzamide;N-(2-fluorophenyl)-3-methyl-4-[3-[(3'R)-3'-methylspiro[indene-1,4'-piperidine]-1'-yl]cyclopentyl]benzamide;N-(3-fluorophenyl)-3-methyl-4-[3-[(3'R)-3'-methylspiro[indene-1,4'-piperidine]-1'-yl]cyclopentyl]benzamide;N-(4-fluorophenyl)-3-methyl-4-[3-[(3'R)-3'-methylspiro[indene-1,4'-piperidine]-1'-yl]cyclopentyl]benzamide;N-(3-methoxyphenyl)-3-methyl-4-[3-[(3'R)-3'-methylspiro[indene-1,4'-piperidine]-1'-yl]cyclopentyl]benzamide;3-methyl-4-[3-[(3'R)-3'-methylspiro[indene-1,4'-piperidine]-1'-yl]cyclopentyl]-N-[3-(trifluoromethyl)phenyl]benzamide
CID 161688226
(2S,3S)-N-(3-tert-butylphenyl)-2-cyclohexyl-1-(2-fluoro-6-methylbenzoyl)piperidine-3-carboxamide;(2S,3S)-N-(3-tert-butylphenyl)-2-cyclopentyl-1-(2-fluoro-6-methylbenzoyl)piperidine-3-carboxamide;(2R,3S)-N-(3-tert-butylphenyl)-1-(2-fluoro-6-methoxybenzoyl)-2-phenylpiperidine-3-carboxamide;(2R,3S)-1-(2-chlorobenzoyl)-2-[4-(cyclopentylamino)phenyl]-N-[4-methyl-3-(trifluoromethyl)phenyl]piperidine-3-carboxamide
CID 162002086
(2R,3S)-2-[4-(cyclopentylamino)phenyl]-N-(3,4-dimethylphenyl)-1-(2-fluoro-6-methylbenzoyl)piperidine-3-carboxamide;(2R,3S)-2-[4-(cyclopentylamino)phenyl]-1-(2-fluoro-6-methylbenzoyl)-N-(4-methyl-3-propan-2-yloxyphenyl)piperidine-3-carboxamide;(2R,3S)-2-[4-(cyclopentylamino)phenyl]-1-(2-fluoro-6-methylbenzoyl)-N-[4-methyl-3-(trifluoromethyl)phenyl]piperidine-3-carboxamide;(2R,3S)-N-(3,4-dimethylphenyl)-1-(2-fluoro-6-methylbenzoyl)-2-[4-[(2-methylpyrrolidin-1-yl)methyl]phenyl]piperidine-3-carboxamide
CID 164987372
tris((2R)-2-[4-(cyclopentylamino)phenyl]-N-(3,4-dimethylphenyl)-1-(2-fluoro-6-methylbenzoyl)piperidine-3-carboxamide);(2R,3S)-2-[4-(cyclopentylamino)phenyl]-1-(2-fluoro-6-methylbenzoyl)-N-(4-methyl-3-pyrrolidin-1-ylphenyl)piperidine-3-carboxamide;(2R)-2-(4-cyclopentyloxyphenyl)-N-(3,4-dimethylphenyl)-1-(2-fluoro-6-methylbenzoyl)piperidine-3-carboxamide
CID 157080143
tris((2R,3S)-2-[4-(cyclopentylamino)phenyl]-N-(3,4-dimethylphenyl)-1-(2-fluoro-6-methylbenzoyl)piperidine-3-carboxamide);(2R,3S)-2-[4-(cyclopentylamino)phenyl]-1-(2-fluoro-6-methylbenzoyl)-N-(4-methyl-3-pyrrolidin-1-ylphenyl)piperidine-3-carboxamide;(2R,3S)-2-(4-cyclopentyloxyphenyl)-N-(3,4-dimethylphenyl)-1-(2-fluoro-6-methylbenzoyl)piperidine-3-carboxamide
CID 157080144
(2R,3S)-N-(3-tert-butylphenyl)-2-[4-[(2-tert-butylpyrrolidin-1-yl)methyl]phenyl]-1-(2-fluoro-6-methylbenzoyl)piperidine-3-carboxamide;(2R,3S)-N-(3-tert-butylphenyl)-2-(4-cyclopentyloxyphenyl)-1-(2-fluoro-6-methylbenzoyl)piperidine-3-carboxamide;(2R,3S)-N-(3-tert-butylphenyl)-1-(2-fluoro-6-methylbenzoyl)-2-[4-[(2-methylcyclopentyl)amino]phenyl]piperidine-3-carboxamide;(2R,3S)-2-[4-(cyclopentylamino)phenyl]-N-(4-ethyl-3-pyrrolidin-1-ylphenyl)-1-(2-fluoro-6-methylbenzoyl)piperidine-3-carboxamide
CID 161120574
(2R)-2-[4-(cyclopentylamino)phenyl]-N-(3,4-dimethylphenyl)-1-(2-fluoro-6-methylbenzoyl)piperidine-3-carboxamide;(2R,3S)-2-[4-(cyclopentylamino)phenyl]-1-(2-fluoro-6-methylbenzoyl)-N-(4-methyl-3-pyrrolidin-1-ylphenyl)piperidine-3-carboxamide;(2R)-2-(4-cyclopentyloxyphenyl)-N-(3,4-dimethylphenyl)-1-(2-fluoro-6-methylbenzoyl)piperidine-3-carboxamide
CID 162005795
bis((2R,3S)-2-[4-(cyclopentylamino)phenyl]-N-(3,4-dimethylphenyl)-1-(2-fluoro-6-methylbenzoyl)piperidine-3-carboxamide);(2R,3S)-2-[4-(cyclopentylamino)phenyl]-1-(2-fluoro-6-methylbenzoyl)-N-(4-methyl-3-pyrrolidin-1-ylphenyl)piperidine-3-carboxamide;(2R,3S)-2-(4-cyclopentyloxyphenyl)-N-(3,4-dimethylphenyl)-1-(2-fluoro-6-methylbenzoyl)piperidine-3-carboxamide
CID 167678743

Frequently Asked Questions

What is the IUPAC name of (2R)-N-(3-chloro-4-methylphenyl)-2-[4-(cyclopentylamino)phenyl]-1-(2-fluoro-6-methylbenzoyl)piperidine-3-carboxamide;(2R)-2-[4-(cyclopentylamino)phenyl]-1-(2-fluoro-6-methylbenzoyl)-N-(3-methyl-1H-inden-5-yl)piperidine-3-carboxamide;2-[4-(cyclopentylamino)phenyl]-1-(2-fluoro-6-methylbenzoyl)-3-methyl-N-[4-methyl-3-(trifluoromethyl)phenyl]piperidine-3-carboxamide;(2R)-2-(4-cyclopentyloxyphenyl)-1-(2-fluoro-6-methylbenzoyl)-N-[4-methyl-3-(trifluoromethyl)phenyl]piperidine-3-carboxamide;(2R)-1-(2-fluoro-6-methylbenzoyl)-2-[4-[(2-methylcyclopentyl)amino]phenyl]-N-[4-methyl-3-(trifluoromethyl)phenyl]piperidine-3-carboxamide?
The IUPAC name of (2R)-N-(3-chloro-4-methylphenyl)-2-[4-(cyclopentylamino)phenyl]-1-(2-fluoro-6-methylbenzoyl)piperidine-3-carboxamide;(2R)-2-[4-(cyclopentylamino)phenyl]-1-(2-fluoro-6-methylbenzoyl)-N-(3-methyl-1H-inden-5-yl)piperidine-3-carboxamide;2-[4-(cyclopentylamino)phenyl]-1-(2-fluoro-6-methylbenzoyl)-3-methyl-N-[4-methyl-3-(trifluoromethyl)phenyl]piperidine-3-carboxamide;(2R)-2-(4-cyclopentyloxyphenyl)-1-(2-fluoro-6-methylbenzoyl)-N-[4-methyl-3-(trifluoromethyl)phenyl]piperidine-3-carboxamide;(2R)-1-(2-fluoro-6-methylbenzoyl)-2-[4-[(2-methylcyclopentyl)amino]phenyl]-N-[4-methyl-3-(trifluoromethyl)phenyl]piperidine-3-carboxamide (CID 160911024) is (2R)-N-(3-chloro-4-methylphenyl)-2-[4-(cyclopentylamino)phenyl]-1-(2-fluoro-6-methylbenzoyl)piperidine-3-carboxamide;(2R)-2-[4-(cyclopentylamino)phenyl]-1-(2-fluoro-6-methylbenzoyl)-N-(3-methyl-1H-inden-5-yl)piperidine-3-carboxamide;2-[4-(cyclopentylamino)phenyl]-1-(2-fluoro-6-methylbenzoyl)-3-methyl-N-[4-methyl-3-(trifluoromethyl)phenyl]piperidine-3-carboxamide;(2R)-2-(4-cyclopentyloxyphenyl)-1-(2-fluoro-6-methylbenzoyl)-N-[4-methyl-3-(trifluoromethyl)phenyl]piperidine-3-carboxamide;(2R)-1-(2-fluoro-6-methylbenzoyl)-2-[4-[(2-methylcyclopentyl)amino]phenyl]-N-[4-methyl-3-(trifluoromethyl)phenyl]piperidine-3-carboxamide.
What is the SMILES notation for (2R)-N-(3-chloro-4-methylphenyl)-2-[4-(cyclopentylamino)phenyl]-1-(2-fluoro-6-methylbenzoyl)piperidine-3-carboxamide;(2R)-2-[4-(cyclopentylamino)phenyl]-1-(2-fluoro-6-methylbenzoyl)-N-(3-methyl-1H-inden-5-yl)piperidine-3-carboxamide;2-[4-(cyclopentylamino)phenyl]-1-(2-fluoro-6-methylbenzoyl)-3-methyl-N-[4-methyl-3-(trifluoromethyl)phenyl]piperidine-3-carboxamide;(2R)-2-(4-cyclopentyloxyphenyl)-1-(2-fluoro-6-methylbenzoyl)-N-[4-methyl-3-(trifluoromethyl)phenyl]piperidine-3-carboxamide;(2R)-1-(2-fluoro-6-methylbenzoyl)-2-[4-[(2-methylcyclopentyl)amino]phenyl]-N-[4-methyl-3-(trifluoromethyl)phenyl]piperidine-3-carboxamide?
The canonical SMILES for (2R)-N-(3-chloro-4-methylphenyl)-2-[4-(cyclopentylamino)phenyl]-1-(2-fluoro-6-methylbenzoyl)piperidine-3-carboxamide;(2R)-2-[4-(cyclopentylamino)phenyl]-1-(2-fluoro-6-methylbenzoyl)-N-(3-methyl-1H-inden-5-yl)piperidine-3-carboxamide;2-[4-(cyclopentylamino)phenyl]-1-(2-fluoro-6-methylbenzoyl)-3-methyl-N-[4-methyl-3-(trifluoromethyl)phenyl]piperidine-3-carboxamide;(2R)-2-(4-cyclopentyloxyphenyl)-1-(2-fluoro-6-methylbenzoyl)-N-[4-methyl-3-(trifluoromethyl)phenyl]piperidine-3-carboxamide;(2R)-1-(2-fluoro-6-methylbenzoyl)-2-[4-[(2-methylcyclopentyl)amino]phenyl]-N-[4-methyl-3-(trifluoromethyl)phenyl]piperidine-3-carboxamide is CC1=CCc2ccc(NC(=O)C3CCCN(C(=O)c4c(C)cccc4F)[C@H]3c3ccc(NC4CCCC4)cc3)cc21.Cc1ccc(NC(=O)C2(C)CCCN(C(=O)c3c(C)cccc3F)C2c2ccc(NC3CCCC3)cc2)cc1C(F)(F)F.Cc1ccc(NC(=O)C2CCCN(C(=O)c3c(C)cccc3F)C2c2ccc(NC3CCCC3)cc2)cc1Cl.Cc1ccc(NC(=O)C2CCCN(C(=O)c3c(C)cccc3F)[C@H]2c2ccc(NC3CCCC3C)cc2)cc1C(F)(F)F.Cc1ccc(NC(=O)C2CCCN(C(=O)c3c(C)cccc3F)[C@H]2c2ccc(OC3CCCC3)cc2)cc1C(F)(F)F.
What is the InChIKey of (2R)-N-(3-chloro-4-methylphenyl)-2-[4-(cyclopentylamino)phenyl]-1-(2-fluoro-6-methylbenzoyl)piperidine-3-carboxamide;(2R)-2-[4-(cyclopentylamino)phenyl]-1-(2-fluoro-6-methylbenzoyl)-N-(3-methyl-1H-inden-5-yl)piperidine-3-carboxamide;2-[4-(cyclopentylamino)phenyl]-1-(2-fluoro-6-methylbenzoyl)-3-methyl-N-[4-methyl-3-(trifluoromethyl)phenyl]piperidine-3-carboxamide;(2R)-2-(4-cyclopentyloxyphenyl)-1-(2-fluoro-6-methylbenzoyl)-N-[4-methyl-3-(trifluoromethyl)phenyl]piperidine-3-carboxamide;(2R)-1-(2-fluoro-6-methylbenzoyl)-2-[4-[(2-methylcyclopentyl)amino]phenyl]-N-[4-methyl-3-(trifluoromethyl)phenyl]piperidine-3-carboxamide?
The InChIKey is SQTXSNOXDSUFDG-LVGHCJKOSA-N. The full InChI is InChI=1S/C35H38FN3O2.2C34H37F4N3O2.C33H34F4N2O3.C32H35ClFN3O2/c1-22-12-13-24-14-19-28(21-30(22)24)38-34(40)29-10-6-20-39(35(41)32-23(2)7-5-11-31(32)36)33(29)25-15-17-27(18-16-25)37-26-8-3-4-9-26;1-20-12-15-25(19-27(20)34(36,37)38)40-32(42)26-9-6-18-41(33(43)30-22(3)8-4-10-28(30)35)31(26)23-13-16-24(17-14-23)39-29-11-5-7-21(29)2;1-21-12-15-26(20-27(21)34(36,37)38)40-32(43)33(3)18-7-19-41(31(42)29-22(2)8-6-11-28(29)35)30(33)23-13-16-25(17-14-23)39-24-9-4-5-10-24;1-20-12-15-23(19-27(20)33(35,36)37)38-31(40)26-10-6-18-39(32(41)29-21(2)7-5-11-28(29)34)30(26)22-13-16-25(17-14-22)42-24-8-3-4-9-24;1-20-12-15-25(19-27(20)33)36-31(38)26-10-6-18-37(32(39)29-21(2)7-5-11-28(29)34)30(26)22-13-16-24(17-14-22)35-23-8-3-4-9-23/h5,7,11-12,14-19,21,26,29,33,37H,3-4,6,8-10,13,20H2,1-2H3,(H,38,40);4,8,10,12-17,19,21,26,29,31,39H,5-7,9,11,18H2,1-3H3,(H,40,42);6,8,11-17,20,24,30,39H,4-5,7,9-10,18-19H2,1-3H3,(H,40,43);5,7,11-17,19,24,26,30H,3-4,6,8-10,18H2,1-2H3,(H,38,40);5,7,11-17,19,23,26,30,35H,3-4,6,8-10,18H2,1-2H3,(H,36,38)/t29?,33-;21?,26?,29?,31-;;26?,30-;/m00.0./s1.
What are the key properties of (2R)-N-(3-chloro-4-methylphenyl)-2-[4-(cyclopentylamino)phenyl]-1-(2-fluoro-6-methylbenzoyl)piperidine-3-carboxamide;(2R)-2-[4-(cyclopentylamino)phenyl]-1-(2-fluoro-6-methylbenzoyl)-N-(3-methyl-1H-inden-5-yl)piperidine-3-carboxamide;2-[4-(cyclopentylamino)phenyl]-1-(2-fluoro-6-methylbenzoyl)-3-methyl-N-[4-methyl-3-(trifluoromethyl)phenyl]piperidine-3-carboxamide;(2R)-2-(4-cyclopentyloxyphenyl)-1-(2-fluoro-6-methylbenzoyl)-N-[4-methyl-3-(trifluoromethyl)phenyl]piperidine-3-carboxamide;(2R)-1-(2-fluoro-6-methylbenzoyl)-2-[4-[(2-methylcyclopentyl)amino]phenyl]-N-[4-methyl-3-(trifluoromethyl)phenyl]piperidine-3-carboxamide?
(2R)-N-(3-chloro-4-methylphenyl)-2-[4-(cyclopentylamino)phenyl]-1-(2-fluoro-6-methylbenzoyl)piperidine-3-carboxamide;(2R)-2-[4-(cyclopentylamino)phenyl]-1-(2-fluoro-6-methylbenzoyl)-N-(3-methyl-1H-inden-5-yl)piperidine-3-carboxamide;2-[4-(cyclopentylamino)phenyl]-1-(2-fluoro-6-methylbenzoyl)-3-methyl-N-[4-methyl-3-(trifluoromethyl)phenyl]piperidine-3-carboxamide;(2R)-2-(4-cyclopentyloxyphenyl)-1-(2-fluoro-6-methylbenzoyl)-N-[4-methyl-3-(trifluoromethyl)phenyl]piperidine-3-carboxamide;(2R)-1-(2-fluoro-6-methylbenzoyl)-2-[4-[(2-methylcyclopentyl)amino]phenyl]-N-[4-methyl-3-(trifluoromethyl)phenyl]piperidine-3-carboxamide has a molecular weight of 2873.81 g/mol, XLogP of 40.11, 30 rotatable bonds, 9 hydrogen bond donors, and 15 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N-(3-chloro-4-methylphenyl)-2-[4-(cyclopentylamino)phenyl]-1-(2-fluoro-6-methylbenzoyl)piperidine-3-carboxamide;(2R)-2-[4-(cyclopentylamino)phenyl]-1-(2-fluoro-6-methylbenzoyl)-N-(3-methyl-1H-inden-5-yl)piperidine-3-carboxamide;2-[4-(cyclopentylamino)phenyl]-1-(2-fluoro-6-methylbenzoyl)-3-methyl-N-[4-methyl-3-(trifluoromethyl)phenyl]piperidine-3-carboxamide;(2R)-2-(4-cyclopentyloxyphenyl)-1-(2-fluoro-6-methylbenzoyl)-N-[4-methyl-3-(trifluoromethyl)phenyl]piperidine-3-carboxamide;(2R)-1-(2-fluoro-6-methylbenzoyl)-2-[4-[(2-methylcyclopentyl)amino]phenyl]-N-[4-methyl-3-(trifluoromethyl)phenyl]piperidine-3-carboxamide is sourced from PubChem (CID 160911024), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).