N-butyl-N-(3,3-dimethylbutyl)piperidine-1-carboxamide

C16H32N2O — CID 18736105

IUPACN-butyl-N-(3,3-dimethylbutyl)piperidine-1-carboxamide
SMILESCCCCN(CCC(C)(C)C)C(=O)N1CCCCC1
InChIInChI=1S/C16H32N2O/c1-5-6-11-18(14-10-16(2,3)4)15(19)17-12-8-7-9-13-17/h5-14H2,1-4H3
InChIKeyXOFMYPACXQFTAE-UHFFFAOYSA-N
MW268.44 g/mol
LogP4.13
Rot. Bonds5

About N-butyl-N-(3,3-dimethylbutyl)piperidine-1-carboxamide

N-butyl-N-(3,3-dimethylbutyl)piperidine-1-carboxamide (PubChem CID 18736105) has the molecular formula C16H32N2O and a molecular weight of 268.44 g/mol. Its IUPAC name is N-butyl-N-(3,3-dimethylbutyl)piperidine-1-carboxamide.

Molecular Properties

Compound NameN-butyl-N-(3,3-dimethylbutyl)piperidine-1-carboxamide
PubChem CID18736105
Molecular FormulaC16H32N2O
Molecular Weight268.44 g/mol
Exact Mass268.25
IUPAC NameN-butyl-N-(3,3-dimethylbutyl)piperidine-1-carboxamide
SMILESCCCCN(CCC(C)(C)C)C(=O)N1CCCCC1
InChIInChI=1S/C16H32N2O/c1-5-6-11-18(14-10-16(2,3)4)15(19)17-12-8-7-9-13-17/h5-14H2,1-4H3
InChIKeyXOFMYPACXQFTAE-UHFFFAOYSA-N
XLogP4.13
TPSA23.55 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.44
LogP ≤ 54.13
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N-butyl-N-(3,3-dimethylbutyl)piperidine-1-carboxamide?
The IUPAC name of N-butyl-N-(3,3-dimethylbutyl)piperidine-1-carboxamide (CID 18736105) is N-butyl-N-(3,3-dimethylbutyl)piperidine-1-carboxamide.
What is the SMILES notation for N-butyl-N-(3,3-dimethylbutyl)piperidine-1-carboxamide?
The canonical SMILES for N-butyl-N-(3,3-dimethylbutyl)piperidine-1-carboxamide is CCCCN(CCC(C)(C)C)C(=O)N1CCCCC1.
What is the InChIKey of N-butyl-N-(3,3-dimethylbutyl)piperidine-1-carboxamide?
The InChIKey is XOFMYPACXQFTAE-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H32N2O/c1-5-6-11-18(14-10-16(2,3)4)15(19)17-12-8-7-9-13-17/h5-14H2,1-4H3.
What are the key properties of N-butyl-N-(3,3-dimethylbutyl)piperidine-1-carboxamide?
N-butyl-N-(3,3-dimethylbutyl)piperidine-1-carboxamide has a molecular weight of 268.44 g/mol, XLogP of 4.13, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-butyl-N-(3,3-dimethylbutyl)piperidine-1-carboxamide is sourced from PubChem (CID 18736105), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).