N-[2-(4-methylphenyl)ethyl]piperidine-4-carboxamide

C15H22N2O — CID 82130753

IUPACN-[2-(4-methylphenyl)ethyl]piperidine-4-carboxamide
SMILESCc1ccc(CCNC(=O)C2CCNCC2)cc1
InChIInChI=1S/C15H22N2O/c1-12-2-4-13(5-3-12)6-11-17-15(18)14-7-9-16-10-8-14/h2-5,14,16H,6-11H2,1H3,(H,17,18)
InChIKeyVYLQSFWKAKLECG-UHFFFAOYSA-N
MW246.35 g/mol
LogP1.65
Rot. Bonds4

About N-[2-(4-methylphenyl)ethyl]piperidine-4-carboxamide

N-[2-(4-methylphenyl)ethyl]piperidine-4-carboxamide (PubChem CID 82130753) has the molecular formula C15H22N2O and a molecular weight of 246.35 g/mol. Its IUPAC name is N-[2-(4-methylphenyl)ethyl]piperidine-4-carboxamide.

Molecular Properties

Compound NameN-[2-(4-methylphenyl)ethyl]piperidine-4-carboxamide
PubChem CID82130753
Molecular FormulaC15H22N2O
Molecular Weight246.35 g/mol
Exact Mass246.17
IUPAC NameN-[2-(4-methylphenyl)ethyl]piperidine-4-carboxamide
SMILESCc1ccc(CCNC(=O)C2CCNCC2)cc1
InChIInChI=1S/C15H22N2O/c1-12-2-4-13(5-3-12)6-11-17-15(18)14-7-9-16-10-8-14/h2-5,14,16H,6-11H2,1H3,(H,17,18)
InChIKeyVYLQSFWKAKLECG-UHFFFAOYSA-N
XLogP1.65
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.35
LogP ≤ 51.65
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-[2-(4-fluorophenyl)ethyl]piperidine-4-carboxamide
CID 16769811
N-[2-(4-phenylphenyl)ethyl]piperidine-4-carboxamide
CID 10968855
N-[2-(4-bromophenyl)ethyl]piperidine-4-carboxamide
CID 82135396
N-[2-(4-fluorophenyl)ethyl]piperidine-4-carboxamide;hydrochloride
CID 119263949
N-[2-(4-acetamidophenyl)ethyl]piperidine-4-carboxamide
CID 119307270
4-[2-(piperidine-4-carbonylamino)ethyl]benzoic acid
CID 61161224
methyl 4-[2-(piperidine-4-carbonylamino)ethyl]benzoate
CID 119277519
N-[2-[4-[2-(4-methylanilino)-2-oxoethoxy]phenyl]ethyl]piperidine-4-carboxamide
CID 119304611
N-[2-[(4-methylbenzoyl)amino]ethyl]piperidine-4-carboxamide;hydrochloride
CID 119299588
N-[2-(3,4-difluorophenyl)ethyl]piperidine-4-carboxamide
CID 115160034
(4R)-N-[2-(3,4-dimethoxyphenyl)ethyl]azepane-4-carboxamide
CID 125447240
N-[2-[4-[2-(4-methylanilino)-2-oxoethoxy]phenyl]ethyl]pyrrolidine-3-carboxamide;hydrochloride
CID 119751120

Frequently Asked Questions

What is the IUPAC name of N-[2-(4-methylphenyl)ethyl]piperidine-4-carboxamide?
The IUPAC name of N-[2-(4-methylphenyl)ethyl]piperidine-4-carboxamide (CID 82130753) is N-[2-(4-methylphenyl)ethyl]piperidine-4-carboxamide.
What is the SMILES notation for N-[2-(4-methylphenyl)ethyl]piperidine-4-carboxamide?
The canonical SMILES for N-[2-(4-methylphenyl)ethyl]piperidine-4-carboxamide is Cc1ccc(CCNC(=O)C2CCNCC2)cc1.
What is the InChIKey of N-[2-(4-methylphenyl)ethyl]piperidine-4-carboxamide?
The InChIKey is VYLQSFWKAKLECG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O/c1-12-2-4-13(5-3-12)6-11-17-15(18)14-7-9-16-10-8-14/h2-5,14,16H,6-11H2,1H3,(H,17,18).
What are the key properties of N-[2-(4-methylphenyl)ethyl]piperidine-4-carboxamide?
N-[2-(4-methylphenyl)ethyl]piperidine-4-carboxamide has a molecular weight of 246.35 g/mol, XLogP of 1.65, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(4-methylphenyl)ethyl]piperidine-4-carboxamide is sourced from PubChem (CID 82130753), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).