N-(5-methyl-2-propan-2-ylcyclohexyl)piperidine-3-carboxamide;hydrochloride

C16H31ClN2O — CID 119304535

IUPACN-(5-methyl-2-propan-2-ylcyclohexyl)piperidine-3-carboxamide;hydrochloride
SMILESCC1CCC(C(C)C)C(NC(=O)C2CCCNC2)C1.Cl
InChIInChI=1S/C16H30N2O.ClH/c1-11(2)14-7-6-12(3)9-15(14)18-16(19)13-5-4-8-17-10-13;/h11-15,17H,4-10H2,1-3H3,(H,18,19);1H
InChIKeyVHSXFYNWZUQMHG-UHFFFAOYSA-N
MW302.89 g/mol
LogP2.98
Rot. Bonds3

About N-(5-methyl-2-propan-2-ylcyclohexyl)piperidine-3-carboxamide;hydrochloride

N-(5-methyl-2-propan-2-ylcyclohexyl)piperidine-3-carboxamide;hydrochloride (PubChem CID 119304535) has the molecular formula C16H31ClN2O and a molecular weight of 302.89 g/mol. Its IUPAC name is N-(5-methyl-2-propan-2-ylcyclohexyl)piperidine-3-carboxamide;hydrochloride.

Molecular Properties

Compound NameN-(5-methyl-2-propan-2-ylcyclohexyl)piperidine-3-carboxamide;hydrochloride
PubChem CID119304535
Molecular FormulaC16H31ClN2O
Molecular Weight302.89 g/mol
Exact Mass302.21
IUPAC NameN-(5-methyl-2-propan-2-ylcyclohexyl)piperidine-3-carboxamide;hydrochloride
SMILESCC1CCC(C(C)C)C(NC(=O)C2CCCNC2)C1.Cl
InChIInChI=1S/C16H30N2O.ClH/c1-11(2)14-7-6-12(3)9-15(14)18-16(19)13-5-4-8-17-10-13;/h11-15,17H,4-10H2,1-3H3,(H,18,19);1H
InChIKeyVHSXFYNWZUQMHG-UHFFFAOYSA-N
XLogP2.98
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.89
LogP ≤ 52.98
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

(3R)-N-(3,5-dimethylcyclohexyl)piperidine-3-carboxamide
CID 81134524
(3S)-N-(3-methylbutan-2-yl)piperidine-3-carboxamide
CID 81123470
(3R)-N-(2-methylcycloheptyl)piperidine-3-carboxamide
CID 81134931
4-methyl-N-(5-methyl-2-propan-2-ylcyclohexyl)piperidine-4-carboxamide
CID 63121777
N-pentan-2-ylpiperidine-3-carboxamide
CID 18072818
N-(2-methylcyclopropyl)pyrrolidine-3-carboxamide
CID 63006462
(2S)-2-[[(3S)-piperidine-3-carbonyl]amino]propanoic acid
CID 81139769
N-[(1R,2R)-2-hydroxycyclohexyl]piperidine-3-carboxamide
CID 107222065
(3S)-N-(3,3-dimethylbutan-2-yl)piperidine-3-carboxamide
CID 104828245
(3S)-N-(1-cyclopropylethyl)piperidine-3-carboxamide
CID 81123770
N-(2,3-dimethylbutyl)piperidine-3-carboxamide;hydrochloride
CID 119330823
3-methyl-N-(5-methyl-2-propan-2-ylcyclohexyl)pyrrolidine-3-carboxamide
CID 63139513

Frequently Asked Questions

What is the IUPAC name of N-(5-methyl-2-propan-2-ylcyclohexyl)piperidine-3-carboxamide;hydrochloride?
The IUPAC name of N-(5-methyl-2-propan-2-ylcyclohexyl)piperidine-3-carboxamide;hydrochloride (CID 119304535) is N-(5-methyl-2-propan-2-ylcyclohexyl)piperidine-3-carboxamide;hydrochloride.
What is the SMILES notation for N-(5-methyl-2-propan-2-ylcyclohexyl)piperidine-3-carboxamide;hydrochloride?
The canonical SMILES for N-(5-methyl-2-propan-2-ylcyclohexyl)piperidine-3-carboxamide;hydrochloride is CC1CCC(C(C)C)C(NC(=O)C2CCCNC2)C1.Cl.
What is the InChIKey of N-(5-methyl-2-propan-2-ylcyclohexyl)piperidine-3-carboxamide;hydrochloride?
The InChIKey is VHSXFYNWZUQMHG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H30N2O.ClH/c1-11(2)14-7-6-12(3)9-15(14)18-16(19)13-5-4-8-17-10-13;/h11-15,17H,4-10H2,1-3H3,(H,18,19);1H.
What are the key properties of N-(5-methyl-2-propan-2-ylcyclohexyl)piperidine-3-carboxamide;hydrochloride?
N-(5-methyl-2-propan-2-ylcyclohexyl)piperidine-3-carboxamide;hydrochloride has a molecular weight of 302.89 g/mol, XLogP of 2.98, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-methyl-2-propan-2-ylcyclohexyl)piperidine-3-carboxamide;hydrochloride is sourced from PubChem (CID 119304535), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).