2-(1-diphenylphosphorylprop-2-enyl)cyclopentan-1-ol

C20H23O2P — CID 15304660

IUPAC2-(1-diphenylphosphorylprop-2-enyl)cyclopentan-1-ol
SMILESC=CC(C1CCCC1O)P(=O)(c1ccccc1)c1ccccc1
InChIInChI=1S/C20H23O2P/c1-2-20(18-14-9-15-19(18)21)23(22,16-10-5-3-6-11-16)17-12-7-4-8-13-17/h2-8,10-13,18-21H,1,9,14-15H2
InChIKeyCEJYKLSXRPRNER-UHFFFAOYSA-N
MW326.38 g/mol
LogP3.72
Rot. Bonds5

About 2-(1-diphenylphosphorylprop-2-enyl)cyclopentan-1-ol

2-(1-diphenylphosphorylprop-2-enyl)cyclopentan-1-ol (PubChem CID 15304660) has the molecular formula C20H23O2P and a molecular weight of 326.38 g/mol. Its IUPAC name is 2-(1-diphenylphosphorylprop-2-enyl)cyclopentan-1-ol.

Molecular Properties

Compound Name2-(1-diphenylphosphorylprop-2-enyl)cyclopentan-1-ol
PubChem CID15304660
Molecular FormulaC20H23O2P
Molecular Weight326.38 g/mol
Exact Mass326.14
IUPAC Name2-(1-diphenylphosphorylprop-2-enyl)cyclopentan-1-ol
SMILESC=CC(C1CCCC1O)P(=O)(c1ccccc1)c1ccccc1
InChIInChI=1S/C20H23O2P/c1-2-20(18-14-9-15-19(18)21)23(22,16-10-5-3-6-11-16)17-12-7-4-8-13-17/h2-8,10-13,18-21H,1,9,14-15H2
InChIKeyCEJYKLSXRPRNER-UHFFFAOYSA-N
XLogP3.72
TPSA37.30 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.38
LogP ≤ 53.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze 2-(1-diphenylphosphorylprop-2-enyl)cyclopentan-1-ol 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-(1-diphenylphosphorylprop-2-enyl)cyclopentan-1-ol?
The IUPAC name of 2-(1-diphenylphosphorylprop-2-enyl)cyclopentan-1-ol (CID 15304660) is 2-(1-diphenylphosphorylprop-2-enyl)cyclopentan-1-ol.
What is the SMILES notation for 2-(1-diphenylphosphorylprop-2-enyl)cyclopentan-1-ol?
The canonical SMILES for 2-(1-diphenylphosphorylprop-2-enyl)cyclopentan-1-ol is C=CC(C1CCCC1O)P(=O)(c1ccccc1)c1ccccc1.
What is the InChIKey of 2-(1-diphenylphosphorylprop-2-enyl)cyclopentan-1-ol?
The InChIKey is CEJYKLSXRPRNER-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H23O2P/c1-2-20(18-14-9-15-19(18)21)23(22,16-10-5-3-6-11-16)17-12-7-4-8-13-17/h2-8,10-13,18-21H,1,9,14-15H2.
What are the key properties of 2-(1-diphenylphosphorylprop-2-enyl)cyclopentan-1-ol?
2-(1-diphenylphosphorylprop-2-enyl)cyclopentan-1-ol has a molecular weight of 326.38 g/mol, XLogP of 3.72, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-diphenylphosphorylprop-2-enyl)cyclopentan-1-ol is sourced from PubChem (CID 15304660), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).