4-[(4-fluorophenyl)methyl]-1-(2-pyridin-4-ylbenzoyl)piperidine-4-carbonitrile;4-[(4-fluorophenyl)methyl]-1-[2-pyridin-4-yl-5-(trifluoromethyl)benzoyl]piperidine-4-carbonitrile;4-[[4-(2-hydroxypropan-2-yl)phenyl]methyl]-1-(2-pyrimidin-4-ylbenzoyl)piperidine-4-carbonitrile;4-(naphthalen-2-ylmethyl)-1-(2-pyrimidin-4-ylbenzoyl)piperidine-4-carbonitrile;1-(2-pyrimidin-4-ylbenzoyl)-4-[[5-(trifluoromethyl)-2-pyridinyl]methyl]piperidine-4-carbonitrile

C130H115F8N19O6 — CID 167573198

IUPAC4-[(4-fluorophenyl)methyl]-1-(2-pyridin-4-ylbenzoyl)piperidine-4-carbonitrile;4-[(4-fluorophenyl)methyl]-1-[2-pyridin-4-yl-5-(trifluoromethyl)benzoyl]piperidine-4-carbonitrile;4-[[4-(2-hydroxypropan-2-yl)phenyl]methyl]-1-(2-pyrimidin-4-ylbenzoyl)piperidine-4-carbonitrile;4-(naphthalen-2-ylmethyl)-1-(2-pyrimidin-4-ylbenzoyl)piperidine-4-carbonitrile;1-(2-pyrimidin-4-ylbenzoyl)-4-[[5-(trifluoromethyl)-2-pyridinyl]methyl]piperidine-4-carbonitrile
SMILESCC(C)(O)c1ccc(CC2(C#N)CCN(C(=O)c3ccccc3-c3ccncn3)CC2)cc1.N#CC1(Cc2ccc(C(F)(F)F)cn2)CCN(C(=O)c2ccccc2-c2ccncn2)CC1.N#CC1(Cc2ccc(F)cc2)CCN(C(=O)c2cc(C(F)(F)F)ccc2-c2ccncc2)CC1.N#CC1(Cc2ccc(F)cc2)CCN(C(=O)c2ccccc2-c2ccncc2)CC1.N#CC1(Cc2ccc3ccccc3c2)CCN(C(=O)c2ccccc2-c2ccncn2)CC1
InChIInChI=1S/C28H24N4O.C27H28N4O2.C26H21F4N3O.C25H22FN3O.C24H20F3N5O/c29-19-28(18-21-9-10-22-5-1-2-6-23(22)17-21)12-15-32(16-13-28)27(33)25-8-4-3-7-24(25)26-11-14-30-20-31-26;1-26(2,33)21-9-7-20(8-10-21)17-27(18-28)12-15-31(16-13-27)25(32)23-6-4-3-5-22(23)24-11-14-29-19-30-24;27-21-4-1-18(2-5-21)16-25(17-31)9-13-33(14-10-25)24(34)23-15-20(26(28,29)30)3-6-22(23)19-7-11-32-12-8-19;26-21-7-5-19(6-8-21)17-25(18-27)11-15-29(16-12-25)24(30)23-4-2-1-3-22(23)20-9-13-28-14-10-20;25-24(26,27)17-5-6-18(30-14-17)13-23(15-28)8-11-32(12-9-23)22(33)20-4-2-1-3-19(20)21-7-10-29-16-31-21/h1-11,14,17,20H,12-13,15-16,18H2;3-11,14,19,33H,12-13,15-17H2,1-2H3;1-8,11-12,15H,9-10,13-14,16H2;1-10,13-14H,11-12,15-17H2;1-7,10,14,16H,8-9,11-13H2
InChIKeyGELIRGWMADAPNU-UHFFFAOYSA-N
MW2191.46 g/mol
LogP24.96
Rot. Bonds21

About 4-[(4-fluorophenyl)methyl]-1-(2-pyridin-4-ylbenzoyl)piperidine-4-carbonitrile;4-[(4-fluorophenyl)methyl]-1-[2-pyridin-4-yl-5-(trifluoromethyl)benzoyl]piperidine-4-carbonitrile;4-[[4-(2-hydroxypropan-2-yl)phenyl]methyl]-1-(2-pyrimidin-4-ylbenzoyl)piperidine-4-carbonitrile;4-(naphthalen-2-ylmethyl)-1-(2-pyrimidin-4-ylbenzoyl)piperidine-4-carbonitrile;1-(2-pyrimidin-4-ylbenzoyl)-4-[[5-(trifluoromethyl)-2-pyridinyl]methyl]piperidine-4-carbonitrile

4-[(4-fluorophenyl)methyl]-1-(2-pyridin-4-ylbenzoyl)piperidine-4-carbonitrile;4-[(4-fluorophenyl)methyl]-1-[2-pyridin-4-yl-5-(trifluoromethyl)benzoyl]piperidine-4-carbonitrile;4-[[4-(2-hydroxypropan-2-yl)phenyl]methyl]-1-(2-pyrimidin-4-ylbenzoyl)piperidine-4-carbonitrile;4-(naphthalen-2-ylmethyl)-1-(2-pyrimidin-4-ylbenzoyl)piperidine-4-carbonitrile;1-(2-pyrimidin-4-ylbenzoyl)-4-[[5-(trifluoromethyl)-2-pyridinyl]methyl]piperidine-4-carbonitrile (PubChem CID 167573198) has the molecular formula C130H115F8N19O6 and a molecular weight of 2191.46 g/mol. Its IUPAC name is 4-[(4-fluorophenyl)methyl]-1-(2-pyridin-4-ylbenzoyl)piperidine-4-carbonitrile;4-[(4-fluorophenyl)methyl]-1-[2-pyridin-4-yl-5-(trifluoromethyl)benzoyl]piperidine-4-carbonitrile;4-[[4-(2-hydroxypropan-2-yl)phenyl]methyl]-1-(2-pyrimidin-4-ylbenzoyl)piperidine-4-carbonitrile;4-(naphthalen-2-ylmethyl)-1-(2-pyrimidin-4-ylbenzoyl)piperidine-4-carbonitrile;1-(2-pyrimidin-4-ylbenzoyl)-4-[[5-(trifluoromethyl)-2-pyridinyl]methyl]piperidine-4-carbonitrile.

Molecular Properties

Compound Name4-[(4-fluorophenyl)methyl]-1-(2-pyridin-4-ylbenzoyl)piperidine-4-carbonitrile;4-[(4-fluorophenyl)methyl]-1-[2-pyridin-4-yl-5-(trifluoromethyl)benzoyl]piperidine-4-carbonitrile;4-[[4-(2-hydroxypropan-2-yl)phenyl]methyl]-1-(2-pyrimidin-4-ylbenzoyl)piperidine-4-carbonitrile;4-(naphthalen-2-ylmethyl)-1-(2-pyrimidin-4-ylbenzoyl)piperidine-4-carbonitrile;1-(2-pyrimidin-4-ylbenzoyl)-4-[[5-(trifluoromethyl)-2-pyridinyl]methyl]piperidine-4-carbonitrile
PubChem CID167573198
Molecular FormulaC130H115F8N19O6
Molecular Weight2191.46 g/mol
Exact Mass2189.91
IUPAC Name4-[(4-fluorophenyl)methyl]-1-(2-pyridin-4-ylbenzoyl)piperidine-4-carbonitrile;4-[(4-fluorophenyl)methyl]-1-[2-pyridin-4-yl-5-(trifluoromethyl)benzoyl]piperidine-4-carbonitrile;4-[[4-(2-hydroxypropan-2-yl)phenyl]methyl]-1-(2-pyrimidin-4-ylbenzoyl)piperidine-4-carbonitrile;4-(naphthalen-2-ylmethyl)-1-(2-pyrimidin-4-ylbenzoyl)piperidine-4-carbonitrile;1-(2-pyrimidin-4-ylbenzoyl)-4-[[5-(trifluoromethyl)-2-pyridinyl]methyl]piperidine-4-carbonitrile
SMILESCC(C)(O)c1ccc(CC2(C#N)CCN(C(=O)c3ccccc3-c3ccncn3)CC2)cc1.N#CC1(Cc2ccc(C(F)(F)F)cn2)CCN(C(=O)c2ccccc2-c2ccncn2)CC1.N#CC1(Cc2ccc(F)cc2)CCN(C(=O)c2cc(C(F)(F)F)ccc2-c2ccncc2)CC1.N#CC1(Cc2ccc(F)cc2)CCN(C(=O)c2ccccc2-c2ccncc2)CC1.N#CC1(Cc2ccc3ccccc3c2)CCN(C(=O)c2ccccc2-c2ccncn2)CC1
InChIInChI=1S/C28H24N4O.C27H28N4O2.C26H21F4N3O.C25H22FN3O.C24H20F3N5O/c29-19-28(18-21-9-10-22-5-1-2-6-23(22)17-21)12-15-32(16-13-28)27(33)25-8-4-3-7-24(25)26-11-14-30-20-31-26;1-26(2,33)21-9-7-20(8-10-21)17-27(18-28)12-15-31(16-13-27)25(32)23-6-4-3-5-22(23)24-11-14-29-19-30-24;27-21-4-1-18(2-5-21)16-25(17-31)9-13-33(14-10-25)24(34)23-15-20(26(28,29)30)3-6-22(23)19-7-11-32-12-8-19;26-21-7-5-19(6-8-21)17-25(18-27)11-15-29(16-12-25)24(30)23-4-2-1-3-22(23)20-9-13-28-14-10-20;25-24(26,27)17-5-6-18(30-14-17)13-23(15-28)8-11-32(12-9-23)22(33)20-4-2-1-3-19(20)21-7-10-29-16-31-21/h1-11,14,17,20H,12-13,15-16,18H2;3-11,14,19,33H,12-13,15-17H2,1-2H3;1-8,11-12,15H,9-10,13-14,16H2;1-10,13-14H,11-12,15-17H2;1-7,10,14,16H,8-9,11-13H2
InChIKeyGELIRGWMADAPNU-UHFFFAOYSA-N
XLogP24.96
TPSA356.74 Ų
H-Bond Donors1
H-Bond Acceptors20
Rotatable Bonds21
Heavy Atoms163
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002191.46
LogP ≤ 524.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 1020

Analyze 4-[(4-fluorophenyl)methyl]-1-(2-pyridin-4-ylbenzoyl)piperidine-4-carbonitrile;4-[(4-fluorophenyl)methyl]-1-[2-pyridin-4-yl-5-(trifluoromethyl)benzoyl]piperidine-4-carbonitrile;4-[[4-(2-hydroxypropan-2-yl)phenyl]methyl]-1-(2-pyrimidin-4-ylbenzoyl)piperidine-4-carbonitrile;4-(naphthalen-2-ylmethyl)-1-(2-pyrimidin-4-ylbenzoyl)piperidine-4-carbonitrile;1-(2-pyrimidin-4-ylbenzoyl)-4-[[5-(trifluoromethyl)-2-pyridinyl]methyl]piperidine-4-carbonitrile with MolForge

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Related Compounds

3-[2-[4-[4-(4,4-difluorocyclohexyl)-3-[[2-fluoro-4-(trifluoromethyl)phenyl]methyl]-7,7-dimethyl-6,8-dihydro-5H-quinolin-2-yl]piperidin-1-yl]pyrimidin-5-yl]benzoic acid
CID 140628414
3-[2-[4-[(5S)-4-(4,4-difluorocyclohexyl)-3-[(S)-fluoro-[4-(trifluoromethyl)phenyl]methyl]-5,7,7-trimethyl-6,8-dihydro-5H-quinolin-2-yl]piperidin-1-yl]pyrimidin-5-yl]benzoic acid
CID 145606651
1-Tert-butyl-4-(2-methylpropyl)-2-(trifluoromethyl)benzene;2-isocyano-4-(2-methylpropyl)pyridine;3-(2-methylpropyl)benzamide;3-(2-methylpropyl)phenol;2-(2-methylpropyl)-6-(trifluoromethyl)pyridine;5-(2-methylpropyl)-2-(trifluoromethyl)pyridine;4-(2-methylpropyl)-2-(trifluoromethyl)pyrimidine
CID 157973318
2-[4-[(2,4-dimethyl-7-oxo-5,6-dihydropyrido[2,3-d]pyrimidin-8-yl)methyl]phenyl]benzoic acid;2-[4-[[2-methyl-7-oxo-4-(trifluoromethyl)-5,6-dihydropyrido[2,3-d]pyrimidin-8-yl]methyl]phenyl]benzonitrile;2-[5-[[2-methyl-7-oxo-4-(trifluoromethyl)-5,6-dihydropyrido[2,3-d]pyrimidin-8-yl]methyl]-2-pyridinyl]benzoic acid;2-methyl-8-[[3-[2-(2H-tetrazol-5-yl)phenyl]phenyl]methyl]-4-(trifluoromethyl)-5,6-dihydropyrido[2,3-d]pyrimidin-7-one
CID 159865635
Tris(2-methyl-5-[3-[4-(6-methyl-3-pyridinyl)-6-(trifluoromethyl)pyrimidin-2-yl]phenyl]benzoic acid);bis(3-methyl-5-[3-[4-(6-methyl-3-pyridinyl)-6-(trifluoromethyl)pyrimidin-2-yl]phenyl]benzoic acid);2-[3-(3-methylphenyl)phenyl]-4-(6-methyl-3-pyridinyl)-6-(trifluoromethyl)pyrimidine
CID 160111438
5-Ethyl-2-[2-oxo-2-[4-[2-(trifluoromethyl)phenyl]piperidin-1-yl]ethyl]benzoic acid;2-[2-oxo-2-[4-[2-(trifluoromethyl)phenyl]piperidin-1-yl]ethyl]benzoic acid;2-[2-oxo-2-[4-[3-(trifluoromethyl)-2-pyridinyl]piperazin-1-yl]ethyl]benzoic acid;2-[2-oxo-2-[4-[5-(trifluoromethyl)pyrimidin-4-yl]piperazin-1-yl]ethyl]benzoic acid
CID 160132797
2-[4-[(2,4-dimethyl-7-oxo-5,6-dihydropyrido[2,3-d]pyrimidin-8-yl)methyl]phenyl]benzoic acid;2-[4-[[2-methyl-7-oxo-4-(trifluoromethyl)-5,6-dihydropyrido[2,3-d]pyrimidin-8-yl]methyl]phenyl]benzonitrile;2-[5-[[2-methyl-7-oxo-4-(trifluoromethyl)-5,6-dihydropyrido[2,3-d]pyrimidin-8-yl]methyl]-2-pyridinyl]benzoic acid;2-methyl-8-[[6-[2-(2H-tetrazol-5-yl)phenyl]-2-pyridinyl]methyl]-4-(trifluoromethyl)-5,6-dihydropyrido[2,3-d]pyrimidin-7-one
CID 161749661
2-(Bromomethyl)-1-fluoro-4-(trifluoromethyl)benzene;tert-butyl 4-cyanocyclohexane-1-carboxylate;tert-butyl 4-cyano-4-[[2-fluoro-5-(trifluoromethyl)phenyl]methyl]piperidine-1-carboxylate;4-[[2-fluoro-5-(trifluoromethyl)phenyl]methyl]piperidine-4-carbonitrile;4-[[2-fluoro-5-(trifluoromethyl)phenyl]methyl]-1-(2-pyrimidin-4-ylpyridine-3-carbonyl)piperidine-4-carbonitrile;methane;2-pyrimidin-4-ylpyridine-3-carboxylic acid;hydrochloride
CID 167537246
4-[(3-Cyclopropylphenyl)methyl]-1-(2-pyrimidin-4-ylbenzoyl)piperidine-4-carbonitrile;4-[(4-cyclopropylphenyl)methyl]-1-(2-pyrimidin-4-ylbenzoyl)piperidine-4-carbonitrile;4-[(3,5-difluorophenyl)methyl]-1-(2-pyrimidin-4-ylbenzoyl)piperidine-4-carbonitrile;4-[(4-fluorophenyl)methyl]-1-(5-fluoro-2-pyridin-4-ylbenzoyl)piperidine-4-carbonitrile;1-(2-pyrimidin-4-ylbenzoyl)-4-[[4-(trifluoromethoxy)phenyl]methyl]piperidine-4-carbonitrile
CID 167543773
4-[[5-(1,1-difluoroethyl)-2-fluorophenyl]methyl]-1-(2-pyridin-4-ylpyridine-3-carbonyl)piperidine-4-carbonitrile;4-[(2-fluoro-4-methylphenyl)methyl]-1-(2-pyridin-4-ylpyridine-3-carbonyl)piperidine-4-carbonitrile;4-[(1S)-1-[2-fluoro-4-(trifluoromethyl)phenyl]ethyl]-1-(2-pyrimidin-4-ylpyridine-3-carbonyl)piperidine-4-carbonitrile
CID 167543785
4-[[4-(1,1-difluoroethyl)-2,6-difluorophenyl]methyl]-1-(2-pyridin-4-ylpyridine-3-carbonyl)piperidine-4-carbonitrile;4-[[4-(1,1-difluoroethyl)-2,6-difluorophenyl]methyl]-1-(2-pyrimidin-4-ylpyridine-3-carbonyl)piperidine-4-carbonitrile;4-[(1R)-1-[4-(1,1-difluoroethyl)-2-fluorophenyl]ethyl]-1-(2-pyrimidin-4-ylpyridine-3-carbonyl)piperidine-4-carbonitrile;4-[[4-(1,1-difluoroethyl)phenyl]methyl]-1-(2-pyridin-4-ylpyridine-3-carbonyl)piperidine-4-carbonitrile;4-[(2,5-difluorophenyl)methyl]-1-(2-pyridin-4-ylpyridine-3-carbonyl)piperidine-4-carbonitrile
CID 167547129
4-[[3-(1,1-difluoroethyl)-2-fluorophenyl]methyl]-1-(2-pyridin-4-ylpyridine-3-carbonyl)piperidine-4-carbonitrile;4-[[3-(1,1-difluoroethyl)-2-fluorophenyl]methyl]-1-(2-pyrimidin-4-ylpyridine-3-carbonyl)piperidine-4-carbonitrile;4-[[2-(1,1-difluoroethyl)phenyl]methyl]-1-(2-pyrimidin-4-ylpyridine-3-carbonyl)piperidine-4-carbonitrile;4-[(1S)-1-(3,5-difluorophenyl)ethyl]-1-(2-pyridin-4-ylbenzoyl)piperidine-4-carbonitrile;4-[(2,5-difluorophenyl)methyl]-1-(2-pyrimidin-4-ylpyridine-3-carbonyl)piperidine-4-carbonitrile
CID 167555547

Frequently Asked Questions

What is the IUPAC name of 4-[(4-fluorophenyl)methyl]-1-(2-pyridin-4-ylbenzoyl)piperidine-4-carbonitrile;4-[(4-fluorophenyl)methyl]-1-[2-pyridin-4-yl-5-(trifluoromethyl)benzoyl]piperidine-4-carbonitrile;4-[[4-(2-hydroxypropan-2-yl)phenyl]methyl]-1-(2-pyrimidin-4-ylbenzoyl)piperidine-4-carbonitrile;4-(naphthalen-2-ylmethyl)-1-(2-pyrimidin-4-ylbenzoyl)piperidine-4-carbonitrile;1-(2-pyrimidin-4-ylbenzoyl)-4-[[5-(trifluoromethyl)-2-pyridinyl]methyl]piperidine-4-carbonitrile?
The IUPAC name of 4-[(4-fluorophenyl)methyl]-1-(2-pyridin-4-ylbenzoyl)piperidine-4-carbonitrile;4-[(4-fluorophenyl)methyl]-1-[2-pyridin-4-yl-5-(trifluoromethyl)benzoyl]piperidine-4-carbonitrile;4-[[4-(2-hydroxypropan-2-yl)phenyl]methyl]-1-(2-pyrimidin-4-ylbenzoyl)piperidine-4-carbonitrile;4-(naphthalen-2-ylmethyl)-1-(2-pyrimidin-4-ylbenzoyl)piperidine-4-carbonitrile;1-(2-pyrimidin-4-ylbenzoyl)-4-[[5-(trifluoromethyl)-2-pyridinyl]methyl]piperidine-4-carbonitrile (CID 167573198) is 4-[(4-fluorophenyl)methyl]-1-(2-pyridin-4-ylbenzoyl)piperidine-4-carbonitrile;4-[(4-fluorophenyl)methyl]-1-[2-pyridin-4-yl-5-(trifluoromethyl)benzoyl]piperidine-4-carbonitrile;4-[[4-(2-hydroxypropan-2-yl)phenyl]methyl]-1-(2-pyrimidin-4-ylbenzoyl)piperidine-4-carbonitrile;4-(naphthalen-2-ylmethyl)-1-(2-pyrimidin-4-ylbenzoyl)piperidine-4-carbonitrile;1-(2-pyrimidin-4-ylbenzoyl)-4-[[5-(trifluoromethyl)-2-pyridinyl]methyl]piperidine-4-carbonitrile.
What is the SMILES notation for 4-[(4-fluorophenyl)methyl]-1-(2-pyridin-4-ylbenzoyl)piperidine-4-carbonitrile;4-[(4-fluorophenyl)methyl]-1-[2-pyridin-4-yl-5-(trifluoromethyl)benzoyl]piperidine-4-carbonitrile;4-[[4-(2-hydroxypropan-2-yl)phenyl]methyl]-1-(2-pyrimidin-4-ylbenzoyl)piperidine-4-carbonitrile;4-(naphthalen-2-ylmethyl)-1-(2-pyrimidin-4-ylbenzoyl)piperidine-4-carbonitrile;1-(2-pyrimidin-4-ylbenzoyl)-4-[[5-(trifluoromethyl)-2-pyridinyl]methyl]piperidine-4-carbonitrile?
The canonical SMILES for 4-[(4-fluorophenyl)methyl]-1-(2-pyridin-4-ylbenzoyl)piperidine-4-carbonitrile;4-[(4-fluorophenyl)methyl]-1-[2-pyridin-4-yl-5-(trifluoromethyl)benzoyl]piperidine-4-carbonitrile;4-[[4-(2-hydroxypropan-2-yl)phenyl]methyl]-1-(2-pyrimidin-4-ylbenzoyl)piperidine-4-carbonitrile;4-(naphthalen-2-ylmethyl)-1-(2-pyrimidin-4-ylbenzoyl)piperidine-4-carbonitrile;1-(2-pyrimidin-4-ylbenzoyl)-4-[[5-(trifluoromethyl)-2-pyridinyl]methyl]piperidine-4-carbonitrile is CC(C)(O)c1ccc(CC2(C#N)CCN(C(=O)c3ccccc3-c3ccncn3)CC2)cc1.N#CC1(Cc2ccc(C(F)(F)F)cn2)CCN(C(=O)c2ccccc2-c2ccncn2)CC1.N#CC1(Cc2ccc(F)cc2)CCN(C(=O)c2cc(C(F)(F)F)ccc2-c2ccncc2)CC1.N#CC1(Cc2ccc(F)cc2)CCN(C(=O)c2ccccc2-c2ccncc2)CC1.N#CC1(Cc2ccc3ccccc3c2)CCN(C(=O)c2ccccc2-c2ccncn2)CC1.
What is the InChIKey of 4-[(4-fluorophenyl)methyl]-1-(2-pyridin-4-ylbenzoyl)piperidine-4-carbonitrile;4-[(4-fluorophenyl)methyl]-1-[2-pyridin-4-yl-5-(trifluoromethyl)benzoyl]piperidine-4-carbonitrile;4-[[4-(2-hydroxypropan-2-yl)phenyl]methyl]-1-(2-pyrimidin-4-ylbenzoyl)piperidine-4-carbonitrile;4-(naphthalen-2-ylmethyl)-1-(2-pyrimidin-4-ylbenzoyl)piperidine-4-carbonitrile;1-(2-pyrimidin-4-ylbenzoyl)-4-[[5-(trifluoromethyl)-2-pyridinyl]methyl]piperidine-4-carbonitrile?
The InChIKey is GELIRGWMADAPNU-UHFFFAOYSA-N. The full InChI is InChI=1S/C28H24N4O.C27H28N4O2.C26H21F4N3O.C25H22FN3O.C24H20F3N5O/c29-19-28(18-21-9-10-22-5-1-2-6-23(22)17-21)12-15-32(16-13-28)27(33)25-8-4-3-7-24(25)26-11-14-30-20-31-26;1-26(2,33)21-9-7-20(8-10-21)17-27(18-28)12-15-31(16-13-27)25(32)23-6-4-3-5-22(23)24-11-14-29-19-30-24;27-21-4-1-18(2-5-21)16-25(17-31)9-13-33(14-10-25)24(34)23-15-20(26(28,29)30)3-6-22(23)19-7-11-32-12-8-19;26-21-7-5-19(6-8-21)17-25(18-27)11-15-29(16-12-25)24(30)23-4-2-1-3-22(23)20-9-13-28-14-10-20;25-24(26,27)17-5-6-18(30-14-17)13-23(15-28)8-11-32(12-9-23)22(33)20-4-2-1-3-19(20)21-7-10-29-16-31-21/h1-11,14,17,20H,12-13,15-16,18H2;3-11,14,19,33H,12-13,15-17H2,1-2H3;1-8,11-12,15H,9-10,13-14,16H2;1-10,13-14H,11-12,15-17H2;1-7,10,14,16H,8-9,11-13H2.
What are the key properties of 4-[(4-fluorophenyl)methyl]-1-(2-pyridin-4-ylbenzoyl)piperidine-4-carbonitrile;4-[(4-fluorophenyl)methyl]-1-[2-pyridin-4-yl-5-(trifluoromethyl)benzoyl]piperidine-4-carbonitrile;4-[[4-(2-hydroxypropan-2-yl)phenyl]methyl]-1-(2-pyrimidin-4-ylbenzoyl)piperidine-4-carbonitrile;4-(naphthalen-2-ylmethyl)-1-(2-pyrimidin-4-ylbenzoyl)piperidine-4-carbonitrile;1-(2-pyrimidin-4-ylbenzoyl)-4-[[5-(trifluoromethyl)-2-pyridinyl]methyl]piperidine-4-carbonitrile?
4-[(4-fluorophenyl)methyl]-1-(2-pyridin-4-ylbenzoyl)piperidine-4-carbonitrile;4-[(4-fluorophenyl)methyl]-1-[2-pyridin-4-yl-5-(trifluoromethyl)benzoyl]piperidine-4-carbonitrile;4-[[4-(2-hydroxypropan-2-yl)phenyl]methyl]-1-(2-pyrimidin-4-ylbenzoyl)piperidine-4-carbonitrile;4-(naphthalen-2-ylmethyl)-1-(2-pyrimidin-4-ylbenzoyl)piperidine-4-carbonitrile;1-(2-pyrimidin-4-ylbenzoyl)-4-[[5-(trifluoromethyl)-2-pyridinyl]methyl]piperidine-4-carbonitrile has a molecular weight of 2191.46 g/mol, XLogP of 24.96, 21 rotatable bonds, 1 hydrogen bond donors, and 20 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(4-fluorophenyl)methyl]-1-(2-pyridin-4-ylbenzoyl)piperidine-4-carbonitrile;4-[(4-fluorophenyl)methyl]-1-[2-pyridin-4-yl-5-(trifluoromethyl)benzoyl]piperidine-4-carbonitrile;4-[[4-(2-hydroxypropan-2-yl)phenyl]methyl]-1-(2-pyrimidin-4-ylbenzoyl)piperidine-4-carbonitrile;4-(naphthalen-2-ylmethyl)-1-(2-pyrimidin-4-ylbenzoyl)piperidine-4-carbonitrile;1-(2-pyrimidin-4-ylbenzoyl)-4-[[5-(trifluoromethyl)-2-pyridinyl]methyl]piperidine-4-carbonitrile is sourced from PubChem (CID 167573198), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).