N-(5,5-dimethylhexan-2-yl)piperidine-2-carboxamide;hydrochloride

C14H29ClN2O — CID 119330827

IUPACN-(5,5-dimethylhexan-2-yl)piperidine-2-carboxamide;hydrochloride
SMILESCC(CCC(C)(C)C)NC(=O)C1CCCCN1.Cl
InChIInChI=1S/C14H28N2O.ClH/c1-11(8-9-14(2,3)4)16-13(17)12-7-5-6-10-15-12;/h11-12,15H,5-10H2,1-4H3,(H,16,17);1H
InChIKeyYELPJOUKXZVJRT-UHFFFAOYSA-N
MW276.85 g/mol
LogP2.88
Rot. Bonds4

About N-(5,5-dimethylhexan-2-yl)piperidine-2-carboxamide;hydrochloride

N-(5,5-dimethylhexan-2-yl)piperidine-2-carboxamide;hydrochloride (PubChem CID 119330827) has the molecular formula C14H29ClN2O and a molecular weight of 276.85 g/mol. Its IUPAC name is N-(5,5-dimethylhexan-2-yl)piperidine-2-carboxamide;hydrochloride.

Molecular Properties

Compound NameN-(5,5-dimethylhexan-2-yl)piperidine-2-carboxamide;hydrochloride
PubChem CID119330827
Molecular FormulaC14H29ClN2O
Molecular Weight276.85 g/mol
Exact Mass276.20
IUPAC NameN-(5,5-dimethylhexan-2-yl)piperidine-2-carboxamide;hydrochloride
SMILESCC(CCC(C)(C)C)NC(=O)C1CCCCN1.Cl
InChIInChI=1S/C14H28N2O.ClH/c1-11(8-9-14(2,3)4)16-13(17)12-7-5-6-10-15-12;/h11-12,15H,5-10H2,1-4H3,(H,16,17);1H
InChIKeyYELPJOUKXZVJRT-UHFFFAOYSA-N
XLogP2.88
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.85
LogP ≤ 52.88
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(5-methylhexan-2-yl)piperidine-2-carboxamide
CID 43579330
(2S)-N-(4-hydroxybutan-2-yl)piperidine-2-carboxamide
CID 104914608
methyl 3-[[(2R)-piperidine-2-carbonyl]amino]butanoate;hydrochloride
CID 119695157
methyl 3-(piperidine-2-carbonylamino)butanoate;hydrochloride
CID 119274282
(2R)-N-(4-methylhexan-2-yl)piperidine-2-carboxamide;hydrochloride
CID 119789194
(2R)-N-(1-methylsulfanylpropan-2-yl)piperidine-2-carboxamide
CID 103812007
N-(4-methylsulfanylbutan-2-yl)azocane-2-carboxamide
CID 114240218
5-(azepane-2-carbonylamino)hexanoic acid
CID 82844956
N-[1-(diethylamino)propan-2-yl]piperidine-2-carboxamide;dihydrochloride
CID 119860546
(2R)-N-[(2S)-1-aminopropan-2-yl]pyrrolidine-2-carboxamide;hydrochloride
CID 130736371
N-(3,3-dimethylbutan-2-yl)azocane-2-carboxamide
CID 114240215
N-(4-phenylbutan-2-yl)piperidine-2-carboxamide;hydrochloride
CID 119262921

Frequently Asked Questions

What is the IUPAC name of N-(5,5-dimethylhexan-2-yl)piperidine-2-carboxamide;hydrochloride?
The IUPAC name of N-(5,5-dimethylhexan-2-yl)piperidine-2-carboxamide;hydrochloride (CID 119330827) is N-(5,5-dimethylhexan-2-yl)piperidine-2-carboxamide;hydrochloride.
What is the SMILES notation for N-(5,5-dimethylhexan-2-yl)piperidine-2-carboxamide;hydrochloride?
The canonical SMILES for N-(5,5-dimethylhexan-2-yl)piperidine-2-carboxamide;hydrochloride is CC(CCC(C)(C)C)NC(=O)C1CCCCN1.Cl.
What is the InChIKey of N-(5,5-dimethylhexan-2-yl)piperidine-2-carboxamide;hydrochloride?
The InChIKey is YELPJOUKXZVJRT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2O.ClH/c1-11(8-9-14(2,3)4)16-13(17)12-7-5-6-10-15-12;/h11-12,15H,5-10H2,1-4H3,(H,16,17);1H.
What are the key properties of N-(5,5-dimethylhexan-2-yl)piperidine-2-carboxamide;hydrochloride?
N-(5,5-dimethylhexan-2-yl)piperidine-2-carboxamide;hydrochloride has a molecular weight of 276.85 g/mol, XLogP of 2.88, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5,5-dimethylhexan-2-yl)piperidine-2-carboxamide;hydrochloride is sourced from PubChem (CID 119330827), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).