2-cyclopent-2-en-1-yl-N-(2,2-difluoroethyl)-N-(2-hydroxyethyl)acetamide

C11H17F2NO2 — CID 107482547

IUPAC2-cyclopent-2-en-1-yl-N-(2,2-difluoroethyl)-N-(2-hydroxyethyl)acetamide
SMILESO=C(CC1C=CCC1)N(CCO)CC(F)F
InChIInChI=1S/C11H17F2NO2/c12-10(13)8-14(5-6-15)11(16)7-9-3-1-2-4-9/h1,3,9-10,15H,2,4-8H2
InChIKeyDCELOWLULVAKHW-UHFFFAOYSA-N
MW233.26 g/mol
LogP1.43
Rot. Bonds6

About 2-cyclopent-2-en-1-yl-N-(2,2-difluoroethyl)-N-(2-hydroxyethyl)acetamide

2-cyclopent-2-en-1-yl-N-(2,2-difluoroethyl)-N-(2-hydroxyethyl)acetamide (PubChem CID 107482547) has the molecular formula C11H17F2NO2 and a molecular weight of 233.26 g/mol. Its IUPAC name is 2-cyclopent-2-en-1-yl-N-(2,2-difluoroethyl)-N-(2-hydroxyethyl)acetamide.

Molecular Properties

Compound Name2-cyclopent-2-en-1-yl-N-(2,2-difluoroethyl)-N-(2-hydroxyethyl)acetamide
PubChem CID107482547
Molecular FormulaC11H17F2NO2
Molecular Weight233.26 g/mol
Exact Mass233.12
IUPAC Name2-cyclopent-2-en-1-yl-N-(2,2-difluoroethyl)-N-(2-hydroxyethyl)acetamide
SMILESO=C(CC1C=CCC1)N(CCO)CC(F)F
InChIInChI=1S/C11H17F2NO2/c12-10(13)8-14(5-6-15)11(16)7-9-3-1-2-4-9/h1,3,9-10,15H,2,4-8H2
InChIKeyDCELOWLULVAKHW-UHFFFAOYSA-N
XLogP1.43
TPSA40.54 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.26
LogP ≤ 51.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze 2-cyclopent-2-en-1-yl-N-(2,2-difluoroethyl)-N-(2-hydroxyethyl)acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-cyclopent-2-en-1-yl-N-(2,2-difluoroethyl)-N-(2-hydroxyethyl)acetamide?
The IUPAC name of 2-cyclopent-2-en-1-yl-N-(2,2-difluoroethyl)-N-(2-hydroxyethyl)acetamide (CID 107482547) is 2-cyclopent-2-en-1-yl-N-(2,2-difluoroethyl)-N-(2-hydroxyethyl)acetamide.
What is the SMILES notation for 2-cyclopent-2-en-1-yl-N-(2,2-difluoroethyl)-N-(2-hydroxyethyl)acetamide?
The canonical SMILES for 2-cyclopent-2-en-1-yl-N-(2,2-difluoroethyl)-N-(2-hydroxyethyl)acetamide is O=C(CC1C=CCC1)N(CCO)CC(F)F.
What is the InChIKey of 2-cyclopent-2-en-1-yl-N-(2,2-difluoroethyl)-N-(2-hydroxyethyl)acetamide?
The InChIKey is DCELOWLULVAKHW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17F2NO2/c12-10(13)8-14(5-6-15)11(16)7-9-3-1-2-4-9/h1,3,9-10,15H,2,4-8H2.
What are the key properties of 2-cyclopent-2-en-1-yl-N-(2,2-difluoroethyl)-N-(2-hydroxyethyl)acetamide?
2-cyclopent-2-en-1-yl-N-(2,2-difluoroethyl)-N-(2-hydroxyethyl)acetamide has a molecular weight of 233.26 g/mol, XLogP of 1.43, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopent-2-en-1-yl-N-(2,2-difluoroethyl)-N-(2-hydroxyethyl)acetamide is sourced from PubChem (CID 107482547), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).