N-(3-acetylphenyl)-3-methylpiperidine-3-carboxamide;hydrochloride

C15H21ClN2O2 — CID 119943623

IUPACN-(3-acetylphenyl)-3-methylpiperidine-3-carboxamide;hydrochloride
SMILESCC(=O)c1cccc(NC(=O)C2(C)CCCNC2)c1.Cl
InChIInChI=1S/C15H20N2O2.ClH/c1-11(18)12-5-3-6-13(9-12)17-14(19)15(2)7-4-8-16-10-15;/h3,5-6,9,16H,4,7-8,10H2,1-2H3,(H,17,19);1H
InChIKeyKMOHLTWWKJIJNZ-UHFFFAOYSA-N
MW296.80 g/mol
LogP2.64
Rot. Bonds3

About N-(3-acetylphenyl)-3-methylpiperidine-3-carboxamide;hydrochloride

N-(3-acetylphenyl)-3-methylpiperidine-3-carboxamide;hydrochloride (PubChem CID 119943623) has the molecular formula C15H21ClN2O2 and a molecular weight of 296.80 g/mol. Its IUPAC name is N-(3-acetylphenyl)-3-methylpiperidine-3-carboxamide;hydrochloride.

Molecular Properties

Compound NameN-(3-acetylphenyl)-3-methylpiperidine-3-carboxamide;hydrochloride
PubChem CID119943623
Molecular FormulaC15H21ClN2O2
Molecular Weight296.80 g/mol
Exact Mass296.13
IUPAC NameN-(3-acetylphenyl)-3-methylpiperidine-3-carboxamide;hydrochloride
SMILESCC(=O)c1cccc(NC(=O)C2(C)CCCNC2)c1.Cl
InChIInChI=1S/C15H20N2O2.ClH/c1-11(18)12-5-3-6-13(9-12)17-14(19)15(2)7-4-8-16-10-15;/h3,5-6,9,16H,4,7-8,10H2,1-2H3,(H,17,19);1H
InChIKeyKMOHLTWWKJIJNZ-UHFFFAOYSA-N
XLogP2.64
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.80
LogP ≤ 52.64
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(3-chlorophenyl)-3-methylpiperidine-3-carboxamide
CID 63132655
3-methyl-N-(3-propan-2-ylphenyl)piperidine-3-carboxamide;hydrochloride
CID 119943872
N-(4-acetamidophenyl)-3-methylpiperidine-3-carboxamide;hydrochloride
CID 119943521
3-methyl-N-pyridin-4-ylpiperidine-3-carboxamide;dihydrochloride
CID 119946059
3-methyl-N-[3-(tetrazol-1-yl)phenyl]piperidine-3-carboxamide;hydrochloride
CID 119943848
N-[3-(dimethylsulfamoyl)phenyl]-3-methylpiperidine-3-carboxamide
CID 119943618
3-methyl-N-[3-(methylsulfamoyl)phenyl]piperidine-3-carboxamide
CID 63130562
3-[(3-ethylpiperidine-3-carbonyl)amino]benzoic acid
CID 63131356
N-[1-(3-acetamidophenyl)ethyl]-3-methylpiperidine-3-carboxamide
CID 119944327
N-(3-imidazol-1-ylphenyl)-3-methylpiperidine-3-carboxamide
CID 63130122
N-(4-chloro-3-fluorophenyl)-3-methylpiperidine-3-carboxamide
CID 63130654
N-(2,2-difluoro-1,3-benzodioxol-5-yl)-3-methylpiperidine-3-carboxamide;hydrochloride
CID 119943991

Frequently Asked Questions

What is the IUPAC name of N-(3-acetylphenyl)-3-methylpiperidine-3-carboxamide;hydrochloride?
The IUPAC name of N-(3-acetylphenyl)-3-methylpiperidine-3-carboxamide;hydrochloride (CID 119943623) is N-(3-acetylphenyl)-3-methylpiperidine-3-carboxamide;hydrochloride.
What is the SMILES notation for N-(3-acetylphenyl)-3-methylpiperidine-3-carboxamide;hydrochloride?
The canonical SMILES for N-(3-acetylphenyl)-3-methylpiperidine-3-carboxamide;hydrochloride is CC(=O)c1cccc(NC(=O)C2(C)CCCNC2)c1.Cl.
What is the InChIKey of N-(3-acetylphenyl)-3-methylpiperidine-3-carboxamide;hydrochloride?
The InChIKey is KMOHLTWWKJIJNZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2O2.ClH/c1-11(18)12-5-3-6-13(9-12)17-14(19)15(2)7-4-8-16-10-15;/h3,5-6,9,16H,4,7-8,10H2,1-2H3,(H,17,19);1H.
What are the key properties of N-(3-acetylphenyl)-3-methylpiperidine-3-carboxamide;hydrochloride?
N-(3-acetylphenyl)-3-methylpiperidine-3-carboxamide;hydrochloride has a molecular weight of 296.80 g/mol, XLogP of 2.64, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-acetylphenyl)-3-methylpiperidine-3-carboxamide;hydrochloride is sourced from PubChem (CID 119943623), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).