2-methyl-N-(3-propan-2-ylphenyl)piperidine-4-carboxamide

C16H24N2O — CID 106738709

IUPAC2-methyl-N-(3-propan-2-ylphenyl)piperidine-4-carboxamide
SMILESCC1CC(C(=O)Nc2cccc(C(C)C)c2)CCN1
InChIInChI=1S/C16H24N2O/c1-11(2)13-5-4-6-15(10-13)18-16(19)14-7-8-17-12(3)9-14/h4-6,10-12,14,17H,7-9H2,1-3H3,(H,18,19)
InChIKeyISZWTXVYKFVUAE-UHFFFAOYSA-N
MW260.38 g/mol
LogP3.14
Rot. Bonds3

About 2-methyl-N-(3-propan-2-ylphenyl)piperidine-4-carboxamide

2-methyl-N-(3-propan-2-ylphenyl)piperidine-4-carboxamide (PubChem CID 106738709) has the molecular formula C16H24N2O and a molecular weight of 260.38 g/mol. Its IUPAC name is 2-methyl-N-(3-propan-2-ylphenyl)piperidine-4-carboxamide.

Molecular Properties

Compound Name2-methyl-N-(3-propan-2-ylphenyl)piperidine-4-carboxamide
PubChem CID106738709
Molecular FormulaC16H24N2O
Molecular Weight260.38 g/mol
Exact Mass260.19
IUPAC Name2-methyl-N-(3-propan-2-ylphenyl)piperidine-4-carboxamide
SMILESCC1CC(C(=O)Nc2cccc(C(C)C)c2)CCN1
InChIInChI=1S/C16H24N2O/c1-11(2)13-5-4-6-15(10-13)18-16(19)14-7-8-17-12(3)9-14/h4-6,10-12,14,17H,7-9H2,1-3H3,(H,18,19)
InChIKeyISZWTXVYKFVUAE-UHFFFAOYSA-N
XLogP3.14
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.38
LogP ≤ 53.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

(2S,4S)-2-methyl-N-(4-propan-2-ylphenyl)piperidine-4-carboxamide
CID 120616359
(2S,4S)-2-methyl-N-(4-propan-2-ylphenyl)piperidine-4-carboxamide;hydrochloride
CID 120616358
(2S,4S)-N-(3-acetamidophenyl)-2-methylpiperidine-4-carboxamide
CID 120616198
(2S,4S)-N-(3-iodophenyl)-2-methylpiperidine-4-carboxamide;hydrochloride
CID 120616575
(2S,4S)-N-[2,6-di(propan-2-yl)phenyl]-2-methylpiperidine-4-carboxamide
CID 120616178
(2S,4S)-N-[3-(difluoromethoxy)phenyl]-2-methylpiperidine-4-carboxamide
CID 120620400
(2S,4S)-N-[1-(3-benzamidophenyl)ethyl]-2-methylpiperidine-4-carboxamide;hydrochloride
CID 120620755
(2S,4S)-N-(3-benzamidophenyl)-2-methylpiperidine-4-carboxamide
CID 120620603
4-amino-N-(3-propan-2-ylphenyl)cyclohexane-1-carboxamide
CID 60848284
N-(3,4-dichlorophenyl)-2-methylpiperidine-4-carboxamide
CID 106738581
(2S,4S)-N-[3-(cyclopropylcarbamoyl)phenyl]-2-methylpiperidine-4-carboxamide
CID 120631994
(2S,4S)-N-[3-(ethylcarbamoylamino)phenyl]-2-methylpiperidine-4-carboxamide;hydrochloride
CID 120626462

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-(3-propan-2-ylphenyl)piperidine-4-carboxamide?
The IUPAC name of 2-methyl-N-(3-propan-2-ylphenyl)piperidine-4-carboxamide (CID 106738709) is 2-methyl-N-(3-propan-2-ylphenyl)piperidine-4-carboxamide.
What is the SMILES notation for 2-methyl-N-(3-propan-2-ylphenyl)piperidine-4-carboxamide?
The canonical SMILES for 2-methyl-N-(3-propan-2-ylphenyl)piperidine-4-carboxamide is CC1CC(C(=O)Nc2cccc(C(C)C)c2)CCN1.
What is the InChIKey of 2-methyl-N-(3-propan-2-ylphenyl)piperidine-4-carboxamide?
The InChIKey is ISZWTXVYKFVUAE-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O/c1-11(2)13-5-4-6-15(10-13)18-16(19)14-7-8-17-12(3)9-14/h4-6,10-12,14,17H,7-9H2,1-3H3,(H,18,19).
What are the key properties of 2-methyl-N-(3-propan-2-ylphenyl)piperidine-4-carboxamide?
2-methyl-N-(3-propan-2-ylphenyl)piperidine-4-carboxamide has a molecular weight of 260.38 g/mol, XLogP of 3.14, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-(3-propan-2-ylphenyl)piperidine-4-carboxamide is sourced from PubChem (CID 106738709), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).