N-ethyl-N-(4-methylphenyl)-6-oxopiperidine-3-carboxamide

C15H20N2O2 — CID 76876121

IUPACN-ethyl-N-(4-methylphenyl)-6-oxopiperidine-3-carboxamide
SMILESCCN(C(=O)C1CCC(=O)NC1)c1ccc(C)cc1
InChIInChI=1S/C15H20N2O2/c1-3-17(13-7-4-11(2)5-8-13)15(19)12-6-9-14(18)16-10-12/h4-5,7-8,12H,3,6,9-10H2,1-2H3,(H,16,18)
InChIKeyBEIOOHJMJACCHH-UHFFFAOYSA-N
MW260.34 g/mol
LogP1.87
Rot. Bonds3

About N-ethyl-N-(4-methylphenyl)-6-oxopiperidine-3-carboxamide

N-ethyl-N-(4-methylphenyl)-6-oxopiperidine-3-carboxamide (PubChem CID 76876121) has the molecular formula C15H20N2O2 and a molecular weight of 260.34 g/mol. Its IUPAC name is N-ethyl-N-(4-methylphenyl)-6-oxopiperidine-3-carboxamide.

Molecular Properties

Compound NameN-ethyl-N-(4-methylphenyl)-6-oxopiperidine-3-carboxamide
PubChem CID76876121
Molecular FormulaC15H20N2O2
Molecular Weight260.34 g/mol
Exact Mass260.15
IUPAC NameN-ethyl-N-(4-methylphenyl)-6-oxopiperidine-3-carboxamide
SMILESCCN(C(=O)C1CCC(=O)NC1)c1ccc(C)cc1
InChIInChI=1S/C15H20N2O2/c1-3-17(13-7-4-11(2)5-8-13)15(19)12-6-9-14(18)16-10-12/h4-5,7-8,12H,3,6,9-10H2,1-2H3,(H,16,18)
InChIKeyBEIOOHJMJACCHH-UHFFFAOYSA-N
XLogP1.87
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.34
LogP ≤ 51.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-ethyl-N-(4-methylphenyl)pyrrolidine-3-carboxamide;hydrochloride
CID 119706995
N-ethyl-N-(4-methylphenyl)piperidine-4-carboxamide;hydrochloride
CID 119280403
3-[ethyl-(4-methylphenyl)carbamoyl]cyclopentane-1-carboxylic acid
CID 103550633
(2R)-N-ethyl-N-(4-methylphenyl)pyrrolidine-2-carboxamide
CID 103794860
N-ethyl-N-(3-hydroxyphenyl)-5-oxopyrrolidine-3-carboxamide
CID 114009924
3-amino-N-ethyl-N-(4-methylphenyl)cyclohexane-1-carboxamide
CID 63046107
N-ethyl-N-(4-fluorophenyl)cyclobutanecarboxamide
CID 39964862
N-methyl-N-(2-methylbutan-2-yl)-6-oxopiperidine-3-carboxamide
CID 78994366
N-benzyl-N-methyl-6-oxopiperidine-3-carboxamide
CID 74464257
N-ethyl-6-oxo-N-pyrrolidin-3-ylpiperidine-3-carboxamide
CID 83192036
N-ethyl-N-phenylpyrrolidine-3-carboxamide;hydrochloride
CID 119670332
N-methyl-6-oxo-N-(3-phenylpropyl)piperidine-3-carboxamide
CID 74878818

Frequently Asked Questions

What is the IUPAC name of N-ethyl-N-(4-methylphenyl)-6-oxopiperidine-3-carboxamide?
The IUPAC name of N-ethyl-N-(4-methylphenyl)-6-oxopiperidine-3-carboxamide (CID 76876121) is N-ethyl-N-(4-methylphenyl)-6-oxopiperidine-3-carboxamide.
What is the SMILES notation for N-ethyl-N-(4-methylphenyl)-6-oxopiperidine-3-carboxamide?
The canonical SMILES for N-ethyl-N-(4-methylphenyl)-6-oxopiperidine-3-carboxamide is CCN(C(=O)C1CCC(=O)NC1)c1ccc(C)cc1.
What is the InChIKey of N-ethyl-N-(4-methylphenyl)-6-oxopiperidine-3-carboxamide?
The InChIKey is BEIOOHJMJACCHH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2O2/c1-3-17(13-7-4-11(2)5-8-13)15(19)12-6-9-14(18)16-10-12/h4-5,7-8,12H,3,6,9-10H2,1-2H3,(H,16,18).
What are the key properties of N-ethyl-N-(4-methylphenyl)-6-oxopiperidine-3-carboxamide?
N-ethyl-N-(4-methylphenyl)-6-oxopiperidine-3-carboxamide has a molecular weight of 260.34 g/mol, XLogP of 1.87, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N-(4-methylphenyl)-6-oxopiperidine-3-carboxamide is sourced from PubChem (CID 76876121), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).