1-phenyl-N-(3-piperidin-1-ylpropanoyl)cyclopentane-1-carboxamide

C20H28N2O2 — CID 4294813

IUPAC1-phenyl-N-(3-piperidin-1-ylpropanoyl)cyclopentane-1-carboxamide
SMILESO=C(CCN1CCCCC1)NC(=O)C1(c2ccccc2)CCCC1
InChIInChI=1S/C20H28N2O2/c23-18(11-16-22-14-7-2-8-15-22)21-19(24)20(12-5-6-13-20)17-9-3-1-4-10-17/h1,3-4,9-10H,2,5-8,11-16H2,(H,21,23,24)
InChIKeyGCLUUIGQPDLBJR-UHFFFAOYSA-N
MW328.46 g/mol
LogP3.02
Rot. Bonds5

About 1-phenyl-N-(3-piperidin-1-ylpropanoyl)cyclopentane-1-carboxamide

1-phenyl-N-(3-piperidin-1-ylpropanoyl)cyclopentane-1-carboxamide (PubChem CID 4294813) has the molecular formula C20H28N2O2 and a molecular weight of 328.46 g/mol. Its IUPAC name is 1-phenyl-N-(3-piperidin-1-ylpropanoyl)cyclopentane-1-carboxamide.

Molecular Properties

Compound Name1-phenyl-N-(3-piperidin-1-ylpropanoyl)cyclopentane-1-carboxamide
PubChem CID4294813
Molecular FormulaC20H28N2O2
Molecular Weight328.46 g/mol
Exact Mass328.22
IUPAC Name1-phenyl-N-(3-piperidin-1-ylpropanoyl)cyclopentane-1-carboxamide
SMILESO=C(CCN1CCCCC1)NC(=O)C1(c2ccccc2)CCCC1
InChIInChI=1S/C20H28N2O2/c23-18(11-16-22-14-7-2-8-15-22)21-19(24)20(12-5-6-13-20)17-9-3-1-4-10-17/h1,3-4,9-10H,2,5-8,11-16H2,(H,21,23,24)
InChIKeyGCLUUIGQPDLBJR-UHFFFAOYSA-N
XLogP3.02
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.46
LogP ≤ 53.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-phenyl-N-(3-piperidin-1-ylpropanoyl)cyclopentane-1-carboxamide?
The IUPAC name of 1-phenyl-N-(3-piperidin-1-ylpropanoyl)cyclopentane-1-carboxamide (CID 4294813) is 1-phenyl-N-(3-piperidin-1-ylpropanoyl)cyclopentane-1-carboxamide.
What is the SMILES notation for 1-phenyl-N-(3-piperidin-1-ylpropanoyl)cyclopentane-1-carboxamide?
The canonical SMILES for 1-phenyl-N-(3-piperidin-1-ylpropanoyl)cyclopentane-1-carboxamide is O=C(CCN1CCCCC1)NC(=O)C1(c2ccccc2)CCCC1.
What is the InChIKey of 1-phenyl-N-(3-piperidin-1-ylpropanoyl)cyclopentane-1-carboxamide?
The InChIKey is GCLUUIGQPDLBJR-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H28N2O2/c23-18(11-16-22-14-7-2-8-15-22)21-19(24)20(12-5-6-13-20)17-9-3-1-4-10-17/h1,3-4,9-10H,2,5-8,11-16H2,(H,21,23,24).
What are the key properties of 1-phenyl-N-(3-piperidin-1-ylpropanoyl)cyclopentane-1-carboxamide?
1-phenyl-N-(3-piperidin-1-ylpropanoyl)cyclopentane-1-carboxamide has a molecular weight of 328.46 g/mol, XLogP of 3.02, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-phenyl-N-(3-piperidin-1-ylpropanoyl)cyclopentane-1-carboxamide is sourced from PubChem (CID 4294813), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).