N-cyclohexyl-3-methyl-5-piperidin-4-ylbenzamide;hydrochloride

C19H29ClN2O — CID 165436170

IUPACN-cyclohexyl-3-methyl-5-piperidin-4-ylbenzamide;hydrochloride
SMILESCc1cc(C(=O)NC2CCCCC2)cc(C2CCNCC2)c1.Cl
InChIInChI=1S/C19H28N2O.ClH/c1-14-11-16(15-7-9-20-10-8-15)13-17(12-14)19(22)21-18-5-3-2-4-6-18;/h11-13,15,18,20H,2-10H2,1H3,(H,21,22);1H
InChIKeyOZTKSDQHKAWURO-UHFFFAOYSA-N
MW336.91 g/mol
LogP3.95
Rot. Bonds3

About N-cyclohexyl-3-methyl-5-piperidin-4-ylbenzamide;hydrochloride

N-cyclohexyl-3-methyl-5-piperidin-4-ylbenzamide;hydrochloride (PubChem CID 165436170) has the molecular formula C19H29ClN2O and a molecular weight of 336.91 g/mol. Its IUPAC name is N-cyclohexyl-3-methyl-5-piperidin-4-ylbenzamide;hydrochloride.

Molecular Properties

Compound NameN-cyclohexyl-3-methyl-5-piperidin-4-ylbenzamide;hydrochloride
PubChem CID165436170
Molecular FormulaC19H29ClN2O
Molecular Weight336.91 g/mol
Exact Mass336.20
IUPAC NameN-cyclohexyl-3-methyl-5-piperidin-4-ylbenzamide;hydrochloride
SMILESCc1cc(C(=O)NC2CCCCC2)cc(C2CCNCC2)c1.Cl
InChIInChI=1S/C19H28N2O.ClH/c1-14-11-16(15-7-9-20-10-8-15)13-17(12-14)19(22)21-18-5-3-2-4-6-18;/h11-13,15,18,20H,2-10H2,1H3,(H,21,22);1H
InChIKeyOZTKSDQHKAWURO-UHFFFAOYSA-N
XLogP3.95
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500336.91
LogP ≤ 53.95
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

3-methyl-N-(oxan-4-yl)-5-piperidin-4-ylbenzamide;hydrochloride
CID 165436172
3-methyl-N-(1-methylpiperidin-4-yl)-5-piperidin-4-ylbenzamide
CID 165436175
N-(3,3-difluorocyclobutyl)-3-methyl-5-piperidin-4-ylbenzamide;hydrochloride
CID 165436162
N-(3,3-difluorocyclobutyl)-3-methyl-5-piperidin-4-ylbenzamide
CID 165436163
3-methyl-N-(oxolan-3-yl)-5-piperidin-4-ylbenzamide
CID 165436167
3-methyl-5-piperidin-4-ylbenzamide;hydrochloride
CID 165436136
N-cyclopentyl-3-piperidin-4-yl-5-(trifluoromethoxy)benzamide
CID 166176272
N-cyclopentyl-2-methyl-5-piperidin-4-ylbenzamide;hydrochloride
CID 171361893
3-amino-N-cyclohexyl-5-methylbenzamide
CID 113396098
3-chloro-N-cyclopentyl-5-methylbenzamide
CID 80948177
3-fluoro-5-methyl-N-[(3S)-piperidin-3-yl]benzamide
CID 99618356
N-cycloheptyl-4-piperidin-4-ylpyridine-2-carboxamide
CID 122570407

Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-3-methyl-5-piperidin-4-ylbenzamide;hydrochloride?
The IUPAC name of N-cyclohexyl-3-methyl-5-piperidin-4-ylbenzamide;hydrochloride (CID 165436170) is N-cyclohexyl-3-methyl-5-piperidin-4-ylbenzamide;hydrochloride.
What is the SMILES notation for N-cyclohexyl-3-methyl-5-piperidin-4-ylbenzamide;hydrochloride?
The canonical SMILES for N-cyclohexyl-3-methyl-5-piperidin-4-ylbenzamide;hydrochloride is Cc1cc(C(=O)NC2CCCCC2)cc(C2CCNCC2)c1.Cl.
What is the InChIKey of N-cyclohexyl-3-methyl-5-piperidin-4-ylbenzamide;hydrochloride?
The InChIKey is OZTKSDQHKAWURO-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H28N2O.ClH/c1-14-11-16(15-7-9-20-10-8-15)13-17(12-14)19(22)21-18-5-3-2-4-6-18;/h11-13,15,18,20H,2-10H2,1H3,(H,21,22);1H.
What are the key properties of N-cyclohexyl-3-methyl-5-piperidin-4-ylbenzamide;hydrochloride?
N-cyclohexyl-3-methyl-5-piperidin-4-ylbenzamide;hydrochloride has a molecular weight of 336.91 g/mol, XLogP of 3.95, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-3-methyl-5-piperidin-4-ylbenzamide;hydrochloride is sourced from PubChem (CID 165436170), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).