N-(4-acetamidophenyl)-3-methylpiperidine-3-carboxamide;hydrochloride

C15H22ClN3O2 — CID 119943521

IUPACN-(4-acetamidophenyl)-3-methylpiperidine-3-carboxamide;hydrochloride
SMILESCC(=O)Nc1ccc(NC(=O)C2(C)CCCNC2)cc1.Cl
InChIInChI=1S/C15H21N3O2.ClH/c1-11(19)17-12-4-6-13(7-5-12)18-14(20)15(2)8-3-9-16-10-15;/h4-7,16H,3,8-10H2,1-2H3,(H,17,19)(H,18,20);1H
InChIKeyQIVWKZLWSTVIIW-UHFFFAOYSA-N
MW311.81 g/mol
LogP2.39
Rot. Bonds3

About N-(4-acetamidophenyl)-3-methylpiperidine-3-carboxamide;hydrochloride

N-(4-acetamidophenyl)-3-methylpiperidine-3-carboxamide;hydrochloride (PubChem CID 119943521) has the molecular formula C15H22ClN3O2 and a molecular weight of 311.81 g/mol. Its IUPAC name is N-(4-acetamidophenyl)-3-methylpiperidine-3-carboxamide;hydrochloride.

Molecular Properties

Compound NameN-(4-acetamidophenyl)-3-methylpiperidine-3-carboxamide;hydrochloride
PubChem CID119943521
Molecular FormulaC15H22ClN3O2
Molecular Weight311.81 g/mol
Exact Mass311.14
IUPAC NameN-(4-acetamidophenyl)-3-methylpiperidine-3-carboxamide;hydrochloride
SMILESCC(=O)Nc1ccc(NC(=O)C2(C)CCCNC2)cc1.Cl
InChIInChI=1S/C15H21N3O2.ClH/c1-11(19)17-12-4-6-13(7-5-12)18-14(20)15(2)8-3-9-16-10-15;/h4-7,16H,3,8-10H2,1-2H3,(H,17,19)(H,18,20);1H
InChIKeyQIVWKZLWSTVIIW-UHFFFAOYSA-N
XLogP2.39
TPSA70.23 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500311.81
LogP ≤ 52.39
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

N-(4-methoxyphenyl)-3-methylpiperidine-3-carboxamide;hydrochloride
CID 119943571
3-methyl-N-[4-(methylcarbamoylamino)phenyl]piperidine-3-carboxamide
CID 63131065
N-[4-(hydroxymethyl)phenyl]-3-methylpiperidine-3-carboxamide
CID 113397758
3-methyl-N-pyridin-4-ylpiperidine-3-carboxamide;dihydrochloride
CID 119946059
N-[(4-acetamidophenyl)methyl]-3-methylpiperidine-3-carboxamide
CID 63134873
3-methyl-N-(4-propylphenyl)piperidine-3-carboxamide
CID 63130315
3-methyl-N-(4-propan-2-yloxyphenyl)piperidine-3-carboxamide;hydrochloride
CID 119944238
3-methyl-N-[4-(triazol-2-yl)phenyl]piperidine-3-carboxamide
CID 63130247
N-(3-acetylphenyl)-3-methylpiperidine-3-carboxamide;hydrochloride
CID 119943623
3-methyl-N-(4-pentylphenyl)piperidine-3-carboxamide
CID 63134870
N-[4-(ethylcarbamoyl)phenyl]-3-methylpiperidine-3-carboxamide
CID 63131115
N-[4-(2-amino-2-oxoethoxy)phenyl]-3-methylpiperidine-3-carboxamide;hydrochloride
CID 119944287

Frequently Asked Questions

What is the IUPAC name of N-(4-acetamidophenyl)-3-methylpiperidine-3-carboxamide;hydrochloride?
The IUPAC name of N-(4-acetamidophenyl)-3-methylpiperidine-3-carboxamide;hydrochloride (CID 119943521) is N-(4-acetamidophenyl)-3-methylpiperidine-3-carboxamide;hydrochloride.
What is the SMILES notation for N-(4-acetamidophenyl)-3-methylpiperidine-3-carboxamide;hydrochloride?
The canonical SMILES for N-(4-acetamidophenyl)-3-methylpiperidine-3-carboxamide;hydrochloride is CC(=O)Nc1ccc(NC(=O)C2(C)CCCNC2)cc1.Cl.
What is the InChIKey of N-(4-acetamidophenyl)-3-methylpiperidine-3-carboxamide;hydrochloride?
The InChIKey is QIVWKZLWSTVIIW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N3O2.ClH/c1-11(19)17-12-4-6-13(7-5-12)18-14(20)15(2)8-3-9-16-10-15;/h4-7,16H,3,8-10H2,1-2H3,(H,17,19)(H,18,20);1H.
What are the key properties of N-(4-acetamidophenyl)-3-methylpiperidine-3-carboxamide;hydrochloride?
N-(4-acetamidophenyl)-3-methylpiperidine-3-carboxamide;hydrochloride has a molecular weight of 311.81 g/mol, XLogP of 2.39, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-acetamidophenyl)-3-methylpiperidine-3-carboxamide;hydrochloride is sourced from PubChem (CID 119943521), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).