N,3-dimethyl-N-pentan-2-ylpiperidine-1-carboxamide

C13H26N2O — CID 116654337

IUPACN,3-dimethyl-N-pentan-2-ylpiperidine-1-carboxamide
SMILESCCCC(C)N(C)C(=O)N1CCCC(C)C1
InChIInChI=1S/C13H26N2O/c1-5-7-12(3)14(4)13(16)15-9-6-8-11(2)10-15/h11-12H,5-10H2,1-4H3
InChIKeyYSNXIDXNTTZLQS-UHFFFAOYSA-N
MW226.36 g/mol
LogP2.96
Rot. Bonds3

About N,3-dimethyl-N-pentan-2-ylpiperidine-1-carboxamide

N,3-dimethyl-N-pentan-2-ylpiperidine-1-carboxamide (PubChem CID 116654337) has the molecular formula C13H26N2O and a molecular weight of 226.36 g/mol. Its IUPAC name is N,3-dimethyl-N-pentan-2-ylpiperidine-1-carboxamide.

Molecular Properties

Compound NameN,3-dimethyl-N-pentan-2-ylpiperidine-1-carboxamide
PubChem CID116654337
Molecular FormulaC13H26N2O
Molecular Weight226.36 g/mol
Exact Mass226.20
IUPAC NameN,3-dimethyl-N-pentan-2-ylpiperidine-1-carboxamide
SMILESCCCC(C)N(C)C(=O)N1CCCC(C)C1
InChIInChI=1S/C13H26N2O/c1-5-7-12(3)14(4)13(16)15-9-6-8-11(2)10-15/h11-12H,5-10H2,1-4H3
InChIKeyYSNXIDXNTTZLQS-UHFFFAOYSA-N
XLogP2.96
TPSA23.55 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.36
LogP ≤ 52.96
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

2-methyl-2-[1-[methyl(pentan-2-yl)carbamoyl]piperidin-3-yl]propanoic acid
CID 83199680
3-methylpiperidine-1-carboxylic acid
CID 22047728
N-cyclopropyl-3-methyl-N-(2-methylpropyl)piperidine-1-carboxamide
CID 116654963
2-amino-1-(3-methylpiperidin-1-yl)pentan-1-one
CID 43649995
(3S)-1-[butan-2-yl(methyl)carbamoyl]piperidine-3-carboxylic acid
CID 81126152
(2R)-1-[methyl(pentan-2-yl)carbamoyl]pyrrolidine-2-carboxylic acid
CID 78922876
N-(4-aminocyclohexyl)-N-ethyl-3-methylpiperidine-1-carboxamide
CID 79162664
N,N-bis(cyclopropylmethyl)-3-methylpiperidine-1-carboxamide
CID 116656196
N,3-dimethyl-N-[2-(methylamino)ethyl]piperidine-1-carboxamide
CID 79163646
N-cyclopentyl-N-(2-hydroxyethyl)-3-methylpiperidine-1-carboxamide
CID 79159584
N-hexan-2-yl-3-methylpiperidine-1-carboxamide
CID 116655502
(2S,3R)-5-methyl-3-(3-methylpiperidine-1-carbonyl)-2-propylhexanamide
CID 10286267

Frequently Asked Questions

What is the IUPAC name of N,3-dimethyl-N-pentan-2-ylpiperidine-1-carboxamide?
The IUPAC name of N,3-dimethyl-N-pentan-2-ylpiperidine-1-carboxamide (CID 116654337) is N,3-dimethyl-N-pentan-2-ylpiperidine-1-carboxamide.
What is the SMILES notation for N,3-dimethyl-N-pentan-2-ylpiperidine-1-carboxamide?
The canonical SMILES for N,3-dimethyl-N-pentan-2-ylpiperidine-1-carboxamide is CCCC(C)N(C)C(=O)N1CCCC(C)C1.
What is the InChIKey of N,3-dimethyl-N-pentan-2-ylpiperidine-1-carboxamide?
The InChIKey is YSNXIDXNTTZLQS-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N2O/c1-5-7-12(3)14(4)13(16)15-9-6-8-11(2)10-15/h11-12H,5-10H2,1-4H3.
What are the key properties of N,3-dimethyl-N-pentan-2-ylpiperidine-1-carboxamide?
N,3-dimethyl-N-pentan-2-ylpiperidine-1-carboxamide has a molecular weight of 226.36 g/mol, XLogP of 2.96, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,3-dimethyl-N-pentan-2-ylpiperidine-1-carboxamide is sourced from PubChem (CID 116654337), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).