2-cyclopent-2-en-1-yl-N-[(4-ethyl-1-hydroxycyclohexyl)methyl]acetamide

C16H27NO2 — CID 65121375

IUPAC2-cyclopent-2-en-1-yl-N-[(4-ethyl-1-hydroxycyclohexyl)methyl]acetamide
SMILESCCC1CCC(O)(CNC(=O)CC2C=CCC2)CC1
InChIInChI=1S/C16H27NO2/c1-2-13-7-9-16(19,10-8-13)12-17-15(18)11-14-5-3-4-6-14/h3,5,13-14,19H,2,4,6-12H2,1H3,(H,17,18)
InChIKeySQSLGAOSAIZHBI-UHFFFAOYSA-N
MW265.40 g/mol
LogP2.79
Rot. Bonds5

About 2-cyclopent-2-en-1-yl-N-[(4-ethyl-1-hydroxycyclohexyl)methyl]acetamide

2-cyclopent-2-en-1-yl-N-[(4-ethyl-1-hydroxycyclohexyl)methyl]acetamide (PubChem CID 65121375) has the molecular formula C16H27NO2 and a molecular weight of 265.40 g/mol. Its IUPAC name is 2-cyclopent-2-en-1-yl-N-[(4-ethyl-1-hydroxycyclohexyl)methyl]acetamide.

Molecular Properties

Compound Name2-cyclopent-2-en-1-yl-N-[(4-ethyl-1-hydroxycyclohexyl)methyl]acetamide
PubChem CID65121375
Molecular FormulaC16H27NO2
Molecular Weight265.40 g/mol
Exact Mass265.20
IUPAC Name2-cyclopent-2-en-1-yl-N-[(4-ethyl-1-hydroxycyclohexyl)methyl]acetamide
SMILESCCC1CCC(O)(CNC(=O)CC2C=CCC2)CC1
InChIInChI=1S/C16H27NO2/c1-2-13-7-9-16(19,10-8-13)12-17-15(18)11-14-5-3-4-6-14/h3,5,13-14,19H,2,4,6-12H2,1H3,(H,17,18)
InChIKeySQSLGAOSAIZHBI-UHFFFAOYSA-N
XLogP2.79
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.40
LogP ≤ 52.79
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze 2-cyclopent-2-en-1-yl-N-[(4-ethyl-1-hydroxycyclohexyl)methyl]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-[(4-ethyl-1-hydroxycyclohexyl)methyl]acetamide?
The IUPAC name of 2-cyclopent-2-en-1-yl-N-[(4-ethyl-1-hydroxycyclohexyl)methyl]acetamide (CID 65121375) is 2-cyclopent-2-en-1-yl-N-[(4-ethyl-1-hydroxycyclohexyl)methyl]acetamide.
What is the SMILES notation for 2-cyclopent-2-en-1-yl-N-[(4-ethyl-1-hydroxycyclohexyl)methyl]acetamide?
The canonical SMILES for 2-cyclopent-2-en-1-yl-N-[(4-ethyl-1-hydroxycyclohexyl)methyl]acetamide is CCC1CCC(O)(CNC(=O)CC2C=CCC2)CC1.
What is the InChIKey of 2-cyclopent-2-en-1-yl-N-[(4-ethyl-1-hydroxycyclohexyl)methyl]acetamide?
The InChIKey is SQSLGAOSAIZHBI-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H27NO2/c1-2-13-7-9-16(19,10-8-13)12-17-15(18)11-14-5-3-4-6-14/h3,5,13-14,19H,2,4,6-12H2,1H3,(H,17,18).
What are the key properties of 2-cyclopent-2-en-1-yl-N-[(4-ethyl-1-hydroxycyclohexyl)methyl]acetamide?
2-cyclopent-2-en-1-yl-N-[(4-ethyl-1-hydroxycyclohexyl)methyl]acetamide has a molecular weight of 265.40 g/mol, XLogP of 2.79, 5 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-[(4-ethyl-1-hydroxycyclohexyl)methyl]acetamide is sourced from PubChem (CID 65121375), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).