1-(4-phenylbutanoyl)piperidine-4-carboxamide

C16H22N2O2 — CID 17311985

IUPAC1-(4-phenylbutanoyl)piperidine-4-carboxamide
SMILESNC(=O)C1CCN(C(=O)CCCc2ccccc2)CC1
InChIInChI=1S/C16H22N2O2/c17-16(20)14-9-11-18(12-10-14)15(19)8-4-7-13-5-2-1-3-6-13/h1-3,5-6,14H,4,7-12H2,(H2,17,20)
InChIKeyUZMCXSURZULSEP-UHFFFAOYSA-N
MW274.36 g/mol
LogP1.73
Rot. Bonds5

About 1-(4-phenylbutanoyl)piperidine-4-carboxamide

1-(4-phenylbutanoyl)piperidine-4-carboxamide (PubChem CID 17311985) has the molecular formula C16H22N2O2 and a molecular weight of 274.36 g/mol. Its IUPAC name is 1-(4-phenylbutanoyl)piperidine-4-carboxamide.

Molecular Properties

Compound Name1-(4-phenylbutanoyl)piperidine-4-carboxamide
PubChem CID17311985
Molecular FormulaC16H22N2O2
Molecular Weight274.36 g/mol
Exact Mass274.17
IUPAC Name1-(4-phenylbutanoyl)piperidine-4-carboxamide
SMILESNC(=O)C1CCN(C(=O)CCCc2ccccc2)CC1
InChIInChI=1S/C16H22N2O2/c17-16(20)14-9-11-18(12-10-14)15(19)8-4-7-13-5-2-1-3-6-13/h1-3,5-6,14H,4,7-12H2,(H2,17,20)
InChIKeyUZMCXSURZULSEP-UHFFFAOYSA-N
XLogP1.73
TPSA63.40 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.36
LogP ≤ 51.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-(4-phenylbutanoyl)piperidine-4-carboxamide?
The IUPAC name of 1-(4-phenylbutanoyl)piperidine-4-carboxamide (CID 17311985) is 1-(4-phenylbutanoyl)piperidine-4-carboxamide.
What is the SMILES notation for 1-(4-phenylbutanoyl)piperidine-4-carboxamide?
The canonical SMILES for 1-(4-phenylbutanoyl)piperidine-4-carboxamide is NC(=O)C1CCN(C(=O)CCCc2ccccc2)CC1.
What is the InChIKey of 1-(4-phenylbutanoyl)piperidine-4-carboxamide?
The InChIKey is UZMCXSURZULSEP-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22N2O2/c17-16(20)14-9-11-18(12-10-14)15(19)8-4-7-13-5-2-1-3-6-13/h1-3,5-6,14H,4,7-12H2,(H2,17,20).
What are the key properties of 1-(4-phenylbutanoyl)piperidine-4-carboxamide?
1-(4-phenylbutanoyl)piperidine-4-carboxamide has a molecular weight of 274.36 g/mol, XLogP of 1.73, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-phenylbutanoyl)piperidine-4-carboxamide is sourced from PubChem (CID 17311985), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).