2-cyclopent-2-en-1-yl-N-[1-(hydroxymethyl)cyclopentyl]acetamide

C13H21NO2 — CID 62517512

IUPAC2-cyclopent-2-en-1-yl-N-[1-(hydroxymethyl)cyclopentyl]acetamide
SMILESO=C(CC1C=CCC1)NC1(CO)CCCC1
InChIInChI=1S/C13H21NO2/c15-10-13(7-3-4-8-13)14-12(16)9-11-5-1-2-6-11/h1,5,11,15H,2-4,6-10H2,(H,14,16)
InChIKeyHRRIUYSBHBQDKL-UHFFFAOYSA-N
MW223.32 g/mol
LogP1.76
Rot. Bonds4

About 2-cyclopent-2-en-1-yl-N-[1-(hydroxymethyl)cyclopentyl]acetamide

2-cyclopent-2-en-1-yl-N-[1-(hydroxymethyl)cyclopentyl]acetamide (PubChem CID 62517512) has the molecular formula C13H21NO2 and a molecular weight of 223.32 g/mol. Its IUPAC name is 2-cyclopent-2-en-1-yl-N-[1-(hydroxymethyl)cyclopentyl]acetamide.

Molecular Properties

Compound Name2-cyclopent-2-en-1-yl-N-[1-(hydroxymethyl)cyclopentyl]acetamide
PubChem CID62517512
Molecular FormulaC13H21NO2
Molecular Weight223.32 g/mol
Exact Mass223.16
IUPAC Name2-cyclopent-2-en-1-yl-N-[1-(hydroxymethyl)cyclopentyl]acetamide
SMILESO=C(CC1C=CCC1)NC1(CO)CCCC1
InChIInChI=1S/C13H21NO2/c15-10-13(7-3-4-8-13)14-12(16)9-11-5-1-2-6-11/h1,5,11,15H,2-4,6-10H2,(H,14,16)
InChIKeyHRRIUYSBHBQDKL-UHFFFAOYSA-N
XLogP1.76
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.32
LogP ≤ 51.76
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-cyclopent-2-en-1-yl-N-[1-(hydroxymethyl)cyclopentyl]acetamide?
The IUPAC name of 2-cyclopent-2-en-1-yl-N-[1-(hydroxymethyl)cyclopentyl]acetamide (CID 62517512) is 2-cyclopent-2-en-1-yl-N-[1-(hydroxymethyl)cyclopentyl]acetamide.
What is the SMILES notation for 2-cyclopent-2-en-1-yl-N-[1-(hydroxymethyl)cyclopentyl]acetamide?
The canonical SMILES for 2-cyclopent-2-en-1-yl-N-[1-(hydroxymethyl)cyclopentyl]acetamide is O=C(CC1C=CCC1)NC1(CO)CCCC1.
What is the InChIKey of 2-cyclopent-2-en-1-yl-N-[1-(hydroxymethyl)cyclopentyl]acetamide?
The InChIKey is HRRIUYSBHBQDKL-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21NO2/c15-10-13(7-3-4-8-13)14-12(16)9-11-5-1-2-6-11/h1,5,11,15H,2-4,6-10H2,(H,14,16).
What are the key properties of 2-cyclopent-2-en-1-yl-N-[1-(hydroxymethyl)cyclopentyl]acetamide?
2-cyclopent-2-en-1-yl-N-[1-(hydroxymethyl)cyclopentyl]acetamide has a molecular weight of 223.32 g/mol, XLogP of 1.76, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopent-2-en-1-yl-N-[1-(hydroxymethyl)cyclopentyl]acetamide is sourced from PubChem (CID 62517512), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).