N-(5-methylhexan-2-yl)piperidine-2-carboxamide

C13H26N2O — CID 43579330

IUPACN-(5-methylhexan-2-yl)piperidine-2-carboxamide
SMILESCC(C)CCC(C)NC(=O)C1CCCCN1
InChIInChI=1S/C13H26N2O/c1-10(2)7-8-11(3)15-13(16)12-6-4-5-9-14-12/h10-12,14H,4-9H2,1-3H3,(H,15,16)
InChIKeyUDHZUTOJJXWKTL-UHFFFAOYSA-N
MW226.36 g/mol
LogP2.07
Rot. Bonds5

About N-(5-methylhexan-2-yl)piperidine-2-carboxamide

N-(5-methylhexan-2-yl)piperidine-2-carboxamide (PubChem CID 43579330) has the molecular formula C13H26N2O and a molecular weight of 226.36 g/mol. Its IUPAC name is N-(5-methylhexan-2-yl)piperidine-2-carboxamide.

Molecular Properties

Compound NameN-(5-methylhexan-2-yl)piperidine-2-carboxamide
PubChem CID43579330
Molecular FormulaC13H26N2O
Molecular Weight226.36 g/mol
Exact Mass226.20
IUPAC NameN-(5-methylhexan-2-yl)piperidine-2-carboxamide
SMILESCC(C)CCC(C)NC(=O)C1CCCCN1
InChIInChI=1S/C13H26N2O/c1-10(2)7-8-11(3)15-13(16)12-6-4-5-9-14-12/h10-12,14H,4-9H2,1-3H3,(H,15,16)
InChIKeyUDHZUTOJJXWKTL-UHFFFAOYSA-N
XLogP2.07
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.36
LogP ≤ 52.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

(2S)-N-(4-hydroxybutan-2-yl)piperidine-2-carboxamide
CID 104914608
N-(5,5-dimethylhexan-2-yl)piperidine-2-carboxamide;hydrochloride
CID 119330827
(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
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
N-(1-methylsulfonylpropan-2-yl)azepane-2-carboxamide
CID 64643195
(2R)-N-(1-ethylsulfanylpropan-2-yl)piperidine-2-carboxamide
CID 103811787
(2R)-N-[1-(3,5-dimethylpiperidin-1-yl)propan-2-yl]piperidine-2-carboxamide
CID 119863487

Frequently Asked Questions

What is the IUPAC name of N-(5-methylhexan-2-yl)piperidine-2-carboxamide?
The IUPAC name of N-(5-methylhexan-2-yl)piperidine-2-carboxamide (CID 43579330) is N-(5-methylhexan-2-yl)piperidine-2-carboxamide.
What is the SMILES notation for N-(5-methylhexan-2-yl)piperidine-2-carboxamide?
The canonical SMILES for N-(5-methylhexan-2-yl)piperidine-2-carboxamide is CC(C)CCC(C)NC(=O)C1CCCCN1.
What is the InChIKey of N-(5-methylhexan-2-yl)piperidine-2-carboxamide?
The InChIKey is UDHZUTOJJXWKTL-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N2O/c1-10(2)7-8-11(3)15-13(16)12-6-4-5-9-14-12/h10-12,14H,4-9H2,1-3H3,(H,15,16).
What are the key properties of N-(5-methylhexan-2-yl)piperidine-2-carboxamide?
N-(5-methylhexan-2-yl)piperidine-2-carboxamide has a molecular weight of 226.36 g/mol, XLogP of 2.07, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-methylhexan-2-yl)piperidine-2-carboxamide is sourced from PubChem (CID 43579330), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).