2-chloro-N-(1-cyclohexylpiperidin-4-yl)-4-(trifluoromethyl)benzamide

C19H24ClF3N2O — CID 155557937

IUPAC2-chloro-N-(1-cyclohexylpiperidin-4-yl)-4-(trifluoromethyl)benzamide
SMILESO=C(NC1CCN(C2CCCCC2)CC1)c1ccc(C(F)(F)F)cc1Cl
InChIInChI=1S/C19H24ClF3N2O/c20-17-12-13(19(21,22)23)6-7-16(17)18(26)24-14-8-10-25(11-9-14)15-4-2-1-3-5-15/h6-7,12,14-15H,1-5,8-11H2,(H,24,26)
InChIKeyOOJVMMHJGLGUIN-UHFFFAOYSA-N
MW388.86 g/mol
LogP4.89
Rot. Bonds3

About 2-chloro-N-(1-cyclohexylpiperidin-4-yl)-4-(trifluoromethyl)benzamide

2-chloro-N-(1-cyclohexylpiperidin-4-yl)-4-(trifluoromethyl)benzamide (PubChem CID 155557937) has the molecular formula C19H24ClF3N2O and a molecular weight of 388.86 g/mol. Its IUPAC name is 2-chloro-N-(1-cyclohexylpiperidin-4-yl)-4-(trifluoromethyl)benzamide.

Molecular Properties

Compound Name2-chloro-N-(1-cyclohexylpiperidin-4-yl)-4-(trifluoromethyl)benzamide
PubChem CID155557937
Molecular FormulaC19H24ClF3N2O
Molecular Weight388.86 g/mol
Exact Mass388.15
IUPAC Name2-chloro-N-(1-cyclohexylpiperidin-4-yl)-4-(trifluoromethyl)benzamide
SMILESO=C(NC1CCN(C2CCCCC2)CC1)c1ccc(C(F)(F)F)cc1Cl
InChIInChI=1S/C19H24ClF3N2O/c20-17-12-13(19(21,22)23)6-7-16(17)18(26)24-14-8-10-25(11-9-14)15-4-2-1-3-5-15/h6-7,12,14-15H,1-5,8-11H2,(H,24,26)
InChIKeyOOJVMMHJGLGUIN-UHFFFAOYSA-N
XLogP4.89
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500388.86
LogP ≤ 54.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

Ssr-504734
CID 9954540
2,3-Dichloro-N-[2-(4,4-difluoro-piperidin-1-yl)-2-(4-fluoro-phenyl)-ethyl]-benzamide
CID 73442861
N-(1-benzyl-4-piperidinyl)-2,4-dichlorobenzamide
CID 1069892
1-(3-Chlorobenzoyl)piperazine
CID 1074765
1-(2-Chloro-benzoyl)-piperazine
CID 2060585
N-(1-(4-chlorophenyl)-3-(dimethylamino)propyl)-4-phenylbenzamide
CID 11663047
N-methyl-SSR504734
CID 11704260
2,6-Dichloro-N-[1-(1-methylethyl)-4-piperidinyl]benzamide
CID 25236799
(2r)-2-Amino-3-(3-Chlorophenyl)-1-[4-(2,5-Difluorobenzoyl)piperazin-1-Yl]propan-1-One
CID 53249967
Benzamide derivative 8
CID 118607347
(3-Chloro-4-fluorophenyl)-[4-fluoro-4-[(3-phenylpropylamino)methyl]piperidin-1-yl]methanone
CID 132256764
4-chloro-N-(2,2,6,6-tetramethylpiperidin-4-yl)benzamide
CID 744756

Frequently Asked Questions

What is the IUPAC name of 2-chloro-N-(1-cyclohexylpiperidin-4-yl)-4-(trifluoromethyl)benzamide?
The IUPAC name of 2-chloro-N-(1-cyclohexylpiperidin-4-yl)-4-(trifluoromethyl)benzamide (CID 155557937) is 2-chloro-N-(1-cyclohexylpiperidin-4-yl)-4-(trifluoromethyl)benzamide.
What is the SMILES notation for 2-chloro-N-(1-cyclohexylpiperidin-4-yl)-4-(trifluoromethyl)benzamide?
The canonical SMILES for 2-chloro-N-(1-cyclohexylpiperidin-4-yl)-4-(trifluoromethyl)benzamide is O=C(NC1CCN(C2CCCCC2)CC1)c1ccc(C(F)(F)F)cc1Cl.
What is the InChIKey of 2-chloro-N-(1-cyclohexylpiperidin-4-yl)-4-(trifluoromethyl)benzamide?
The InChIKey is OOJVMMHJGLGUIN-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24ClF3N2O/c20-17-12-13(19(21,22)23)6-7-16(17)18(26)24-14-8-10-25(11-9-14)15-4-2-1-3-5-15/h6-7,12,14-15H,1-5,8-11H2,(H,24,26).
What are the key properties of 2-chloro-N-(1-cyclohexylpiperidin-4-yl)-4-(trifluoromethyl)benzamide?
2-chloro-N-(1-cyclohexylpiperidin-4-yl)-4-(trifluoromethyl)benzamide has a molecular weight of 388.86 g/mol, XLogP of 4.89, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-N-(1-cyclohexylpiperidin-4-yl)-4-(trifluoromethyl)benzamide is sourced from PubChem (CID 155557937), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).