2-(3-cyclobutylphenyl)piperidine-3-carboxamide

C16H22N2O — CID 114606016

IUPAC2-(3-cyclobutylphenyl)piperidine-3-carboxamide
SMILESNC(=O)C1CCCNC1c1cccc(C2CCC2)c1
InChIInChI=1S/C16H22N2O/c17-16(19)14-8-3-9-18-15(14)13-7-2-6-12(10-13)11-4-1-5-11/h2,6-7,10-11,14-15,18H,1,3-5,8-9H2,(H2,17,19)
InChIKeyLBNXHXHPJFGJRW-UHFFFAOYSA-N
MW258.36 g/mol
LogP2.48
Rot. Bonds3

About 2-(3-cyclobutylphenyl)piperidine-3-carboxamide

2-(3-cyclobutylphenyl)piperidine-3-carboxamide (PubChem CID 114606016) has the molecular formula C16H22N2O and a molecular weight of 258.36 g/mol. Its IUPAC name is 2-(3-cyclobutylphenyl)piperidine-3-carboxamide.

Molecular Properties

Compound Name2-(3-cyclobutylphenyl)piperidine-3-carboxamide
PubChem CID114606016
Molecular FormulaC16H22N2O
Molecular Weight258.36 g/mol
Exact Mass258.17
IUPAC Name2-(3-cyclobutylphenyl)piperidine-3-carboxamide
SMILESNC(=O)C1CCCNC1c1cccc(C2CCC2)c1
InChIInChI=1S/C16H22N2O/c17-16(19)14-8-3-9-18-15(14)13-7-2-6-12(10-13)11-4-1-5-11/h2,6-7,10-11,14-15,18H,1,3-5,8-9H2,(H2,17,19)
InChIKeyLBNXHXHPJFGJRW-UHFFFAOYSA-N
XLogP2.48
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.36
LogP ≤ 52.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(3-cyclobutylphenyl)piperidine-3-carboxamide?
The IUPAC name of 2-(3-cyclobutylphenyl)piperidine-3-carboxamide (CID 114606016) is 2-(3-cyclobutylphenyl)piperidine-3-carboxamide.
What is the SMILES notation for 2-(3-cyclobutylphenyl)piperidine-3-carboxamide?
The canonical SMILES for 2-(3-cyclobutylphenyl)piperidine-3-carboxamide is NC(=O)C1CCCNC1c1cccc(C2CCC2)c1.
What is the InChIKey of 2-(3-cyclobutylphenyl)piperidine-3-carboxamide?
The InChIKey is LBNXHXHPJFGJRW-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22N2O/c17-16(19)14-8-3-9-18-15(14)13-7-2-6-12(10-13)11-4-1-5-11/h2,6-7,10-11,14-15,18H,1,3-5,8-9H2,(H2,17,19).
What are the key properties of 2-(3-cyclobutylphenyl)piperidine-3-carboxamide?
2-(3-cyclobutylphenyl)piperidine-3-carboxamide has a molecular weight of 258.36 g/mol, XLogP of 2.48, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-cyclobutylphenyl)piperidine-3-carboxamide is sourced from PubChem (CID 114606016), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).