N-cyclopentyl-2-methyl-5-piperidin-4-ylbenzamide;hydrochloride

C18H27ClN2O — CID 171361893

IUPACN-cyclopentyl-2-methyl-5-piperidin-4-ylbenzamide;hydrochloride
SMILESCc1ccc(C2CCNCC2)cc1C(=O)NC1CCCC1.Cl
InChIInChI=1S/C18H26N2O.ClH/c1-13-6-7-15(14-8-10-19-11-9-14)12-17(13)18(21)20-16-4-2-3-5-16;/h6-7,12,14,16,19H,2-5,8-11H2,1H3,(H,20,21);1H
InChIKeyMULWRHQOTPCWAH-UHFFFAOYSA-N
MW322.88 g/mol
LogP3.56
Rot. Bonds3

About N-cyclopentyl-2-methyl-5-piperidin-4-ylbenzamide;hydrochloride

N-cyclopentyl-2-methyl-5-piperidin-4-ylbenzamide;hydrochloride (PubChem CID 171361893) has the molecular formula C18H27ClN2O and a molecular weight of 322.88 g/mol. Its IUPAC name is N-cyclopentyl-2-methyl-5-piperidin-4-ylbenzamide;hydrochloride.

Molecular Properties

Compound NameN-cyclopentyl-2-methyl-5-piperidin-4-ylbenzamide;hydrochloride
PubChem CID171361893
Molecular FormulaC18H27ClN2O
Molecular Weight322.88 g/mol
Exact Mass322.18
IUPAC NameN-cyclopentyl-2-methyl-5-piperidin-4-ylbenzamide;hydrochloride
SMILESCc1ccc(C2CCNCC2)cc1C(=O)NC1CCCC1.Cl
InChIInChI=1S/C18H26N2O.ClH/c1-13-6-7-15(14-8-10-19-11-9-14)12-17(13)18(21)20-16-4-2-3-5-16;/h6-7,12,14,16,19H,2-5,8-11H2,1H3,(H,20,21);1H
InChIKeyMULWRHQOTPCWAH-UHFFFAOYSA-N
XLogP3.56
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.88
LogP ≤ 53.56
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-methyl-N-(oxolan-3-yl)-5-piperidin-4-ylbenzamide;hydrochloride
CID 171361895
N,2-dimethyl-5-piperidin-4-ylbenzamide
CID 171361874
2-methyl-5-piperidin-4-ylbenzamide
CID 175991950
N-cyclopentyl-4-piperidin-4-yl-2-(trifluoromethoxy)benzamide;hydrochloride
CID 166001185
5-fluoro-2-methyl-N-piperidin-4-ylbenzamide;hydrochloride
CID 119389522
N-cyclohexyl-3-methyl-5-piperidin-4-ylbenzamide;hydrochloride
CID 165436170
N-cyclohexyl-2,5-dimethylbenzamide
CID 925443
N-cycloheptyl-4-piperidin-4-ylpyridine-2-carboxamide
CID 122570407
2-fluoro-N-(oxan-4-yl)-5-piperidin-4-ylbenzamide
CID 171361952
N-cyclohexyl-2-piperidin-4-ylbenzamide;hydrochloride
CID 170456891
5-chloro-N-cyclohexyl-2-methylbenzamide
CID 83407385
N-(azepan-3-yl)-5-bromo-2-methylbenzamide
CID 65311485

Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-2-methyl-5-piperidin-4-ylbenzamide;hydrochloride?
The IUPAC name of N-cyclopentyl-2-methyl-5-piperidin-4-ylbenzamide;hydrochloride (CID 171361893) is N-cyclopentyl-2-methyl-5-piperidin-4-ylbenzamide;hydrochloride.
What is the SMILES notation for N-cyclopentyl-2-methyl-5-piperidin-4-ylbenzamide;hydrochloride?
The canonical SMILES for N-cyclopentyl-2-methyl-5-piperidin-4-ylbenzamide;hydrochloride is Cc1ccc(C2CCNCC2)cc1C(=O)NC1CCCC1.Cl.
What is the InChIKey of N-cyclopentyl-2-methyl-5-piperidin-4-ylbenzamide;hydrochloride?
The InChIKey is MULWRHQOTPCWAH-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H26N2O.ClH/c1-13-6-7-15(14-8-10-19-11-9-14)12-17(13)18(21)20-16-4-2-3-5-16;/h6-7,12,14,16,19H,2-5,8-11H2,1H3,(H,20,21);1H.
What are the key properties of N-cyclopentyl-2-methyl-5-piperidin-4-ylbenzamide;hydrochloride?
N-cyclopentyl-2-methyl-5-piperidin-4-ylbenzamide;hydrochloride has a molecular weight of 322.88 g/mol, XLogP of 3.56, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-2-methyl-5-piperidin-4-ylbenzamide;hydrochloride is sourced from PubChem (CID 171361893), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).