N-(2-methyl-6-propan-2-ylphenyl)piperidine-3-carboxamide;hydrochloride

C16H25ClN2O — CID 119263416

IUPACN-(2-methyl-6-propan-2-ylphenyl)piperidine-3-carboxamide;hydrochloride
SMILESCc1cccc(C(C)C)c1NC(=O)C1CCCNC1.Cl
InChIInChI=1S/C16H24N2O.ClH/c1-11(2)14-8-4-6-12(3)15(14)18-16(19)13-7-5-9-17-10-13;/h4,6,8,11,13,17H,5,7,9-10H2,1-3H3,(H,18,19);1H
InChIKeyOLJHGHXDDPSEPP-UHFFFAOYSA-N
MW296.84 g/mol
LogP3.48
Rot. Bonds3

About N-(2-methyl-6-propan-2-ylphenyl)piperidine-3-carboxamide;hydrochloride

N-(2-methyl-6-propan-2-ylphenyl)piperidine-3-carboxamide;hydrochloride (PubChem CID 119263416) has the molecular formula C16H25ClN2O and a molecular weight of 296.84 g/mol. Its IUPAC name is N-(2-methyl-6-propan-2-ylphenyl)piperidine-3-carboxamide;hydrochloride.

Molecular Properties

Compound NameN-(2-methyl-6-propan-2-ylphenyl)piperidine-3-carboxamide;hydrochloride
PubChem CID119263416
Molecular FormulaC16H25ClN2O
Molecular Weight296.84 g/mol
Exact Mass296.17
IUPAC NameN-(2-methyl-6-propan-2-ylphenyl)piperidine-3-carboxamide;hydrochloride
SMILESCc1cccc(C(C)C)c1NC(=O)C1CCCNC1.Cl
InChIInChI=1S/C16H24N2O.ClH/c1-11(2)14-8-4-6-12(3)15(14)18-16(19)13-7-5-9-17-10-13;/h4,6,8,11,13,17H,5,7,9-10H2,1-3H3,(H,18,19);1H
InChIKeyOLJHGHXDDPSEPP-UHFFFAOYSA-N
XLogP3.48
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.84
LogP ≤ 53.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

(3S)-N-[1-(2-methylphenyl)ethyl]piperidine-3-carboxamide
CID 81140463
N-(2-methyl-6-propan-2-ylphenyl)piperazine-2-carboxamide
CID 63104160
4-[(2-methyl-6-propan-2-ylphenyl)carbamoyl]cyclohexane-1-carboxylic acid
CID 120672180
N-[3-methyl-1-(2-methylphenyl)butyl]piperidine-3-carboxamide;hydrochloride
CID 119323136
N-(2-methyl-6-propan-2-ylphenyl)piperidine-2-carboxamide
CID 10730082
4-N-tert-butyl-1-N-(2-methyl-6-propan-2-ylphenyl)cyclohexane-1,4-dicarboxamide
CID 109149581
N-[2,6-di(propan-2-yl)phenyl]cyclohexanecarboxamide
CID 729635
N-(2-methyl-6-propan-2-ylphenyl)thiolane-3-carboxamide
CID 110858311
N-(2-chloro-4-methyl-3-pyridinyl)piperidine-3-carboxamide
CID 65490081
(3S)-N-(4-bromo-2,6-dimethylphenyl)piperidine-3-carboxamide
CID 28562759
2-methyl-N-(piperidin-3-ylmethyl)-6-propan-2-ylaniline
CID 82086323
N-[1-(2-chlorophenyl)ethyl]piperidine-3-carboxamide
CID 61258238

Frequently Asked Questions

What is the IUPAC name of N-(2-methyl-6-propan-2-ylphenyl)piperidine-3-carboxamide;hydrochloride?
The IUPAC name of N-(2-methyl-6-propan-2-ylphenyl)piperidine-3-carboxamide;hydrochloride (CID 119263416) is N-(2-methyl-6-propan-2-ylphenyl)piperidine-3-carboxamide;hydrochloride.
What is the SMILES notation for N-(2-methyl-6-propan-2-ylphenyl)piperidine-3-carboxamide;hydrochloride?
The canonical SMILES for N-(2-methyl-6-propan-2-ylphenyl)piperidine-3-carboxamide;hydrochloride is Cc1cccc(C(C)C)c1NC(=O)C1CCCNC1.Cl.
What is the InChIKey of N-(2-methyl-6-propan-2-ylphenyl)piperidine-3-carboxamide;hydrochloride?
The InChIKey is OLJHGHXDDPSEPP-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O.ClH/c1-11(2)14-8-4-6-12(3)15(14)18-16(19)13-7-5-9-17-10-13;/h4,6,8,11,13,17H,5,7,9-10H2,1-3H3,(H,18,19);1H.
What are the key properties of N-(2-methyl-6-propan-2-ylphenyl)piperidine-3-carboxamide;hydrochloride?
N-(2-methyl-6-propan-2-ylphenyl)piperidine-3-carboxamide;hydrochloride has a molecular weight of 296.84 g/mol, XLogP of 3.48, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methyl-6-propan-2-ylphenyl)piperidine-3-carboxamide;hydrochloride is sourced from PubChem (CID 119263416), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).