N-(2,3-dimethylbutyl)piperidine-3-carboxamide;hydrochloride

C12H25ClN2O — CID 119330823

IUPACN-(2,3-dimethylbutyl)piperidine-3-carboxamide;hydrochloride
SMILESCC(C)C(C)CNC(=O)C1CCCNC1.Cl
InChIInChI=1S/C12H24N2O.ClH/c1-9(2)10(3)7-14-12(15)11-5-4-6-13-8-11;/h9-11,13H,4-8H2,1-3H3,(H,14,15);1H
InChIKeyUARUPPQEUNJYLY-UHFFFAOYSA-N
MW248.80 g/mol
LogP1.82
Rot. Bonds4

About N-(2,3-dimethylbutyl)piperidine-3-carboxamide;hydrochloride

N-(2,3-dimethylbutyl)piperidine-3-carboxamide;hydrochloride (PubChem CID 119330823) has the molecular formula C12H25ClN2O and a molecular weight of 248.80 g/mol. Its IUPAC name is N-(2,3-dimethylbutyl)piperidine-3-carboxamide;hydrochloride.

Molecular Properties

Compound NameN-(2,3-dimethylbutyl)piperidine-3-carboxamide;hydrochloride
PubChem CID119330823
Molecular FormulaC12H25ClN2O
Molecular Weight248.80 g/mol
Exact Mass248.17
IUPAC NameN-(2,3-dimethylbutyl)piperidine-3-carboxamide;hydrochloride
SMILESCC(C)C(C)CNC(=O)C1CCCNC1.Cl
InChIInChI=1S/C12H24N2O.ClH/c1-9(2)10(3)7-14-12(15)11-5-4-6-13-8-11;/h9-11,13H,4-8H2,1-3H3,(H,14,15);1H
InChIKeyUARUPPQEUNJYLY-UHFFFAOYSA-N
XLogP1.82
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.80
LogP ≤ 51.82
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-ethylpiperidine-3-carboxamide;hydrochloride
CID 53410852
propan-2-yl 2-methyl-3-(piperidine-3-carbonylamino)propanoate;hydrochloride
CID 119338471
(3R)-N-(3-methoxy-2-methylpropyl)piperidine-3-carboxamide
CID 81140932
(3S)-N-(3-methylbutan-2-yl)piperidine-3-carboxamide
CID 81123470
(3S)-N-(2-methylpropyl)pyrrolidine-3-carboxamide;hydrochloride
CID 130617113
N-(2,3-dihydroxypropyl)piperidine-3-carboxamide
CID 66169749
2-hydroxy-3-[[(3R)-piperidine-3-carbonyl]amino]propanoic acid
CID 81134818
N-(2-cyclopropyl-2-hydroxyethyl)piperidine-3-carboxamide
CID 63297016
methyl 2-hydroxy-3-[[(3S)-piperidine-3-carbonyl]amino]propanoate
CID 107222681
(3S)-N-(3,3-dimethylbutan-2-yl)piperidine-3-carboxamide
CID 104828245
(3R)-N-[2-(dimethylamino)-4-methylpentyl]piperidine-3-carboxamide
CID 81141730
N-(3-methyl-2-phenylbutyl)piperidine-3-carboxamide
CID 119294119

Frequently Asked Questions

What is the IUPAC name of N-(2,3-dimethylbutyl)piperidine-3-carboxamide;hydrochloride?
The IUPAC name of N-(2,3-dimethylbutyl)piperidine-3-carboxamide;hydrochloride (CID 119330823) is N-(2,3-dimethylbutyl)piperidine-3-carboxamide;hydrochloride.
What is the SMILES notation for N-(2,3-dimethylbutyl)piperidine-3-carboxamide;hydrochloride?
The canonical SMILES for N-(2,3-dimethylbutyl)piperidine-3-carboxamide;hydrochloride is CC(C)C(C)CNC(=O)C1CCCNC1.Cl.
What is the InChIKey of N-(2,3-dimethylbutyl)piperidine-3-carboxamide;hydrochloride?
The InChIKey is UARUPPQEUNJYLY-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2O.ClH/c1-9(2)10(3)7-14-12(15)11-5-4-6-13-8-11;/h9-11,13H,4-8H2,1-3H3,(H,14,15);1H.
What are the key properties of N-(2,3-dimethylbutyl)piperidine-3-carboxamide;hydrochloride?
N-(2,3-dimethylbutyl)piperidine-3-carboxamide;hydrochloride has a molecular weight of 248.80 g/mol, XLogP of 1.82, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,3-dimethylbutyl)piperidine-3-carboxamide;hydrochloride is sourced from PubChem (CID 119330823), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).