2-ethyl-4-phenylpentan-1-ol

C13H20O — CID 71626518

IUPAC2-ethyl-4-phenylpentan-1-ol
SMILESCCC(CO)CC(C)c1ccccc1
InChIInChI=1S/C13H20O/c1-3-12(10-14)9-11(2)13-7-5-4-6-8-13/h4-8,11-12,14H,3,9-10H2,1-2H3
InChIKeySYBZRZVYXNPFGS-UHFFFAOYSA-N
MW192.30 g/mol
LogP3.20
Rot. Bonds5

About 2-ethyl-4-phenylpentan-1-ol

2-ethyl-4-phenylpentan-1-ol (PubChem CID 71626518) has the molecular formula C13H20O and a molecular weight of 192.30 g/mol. Its IUPAC name is 2-ethyl-4-phenylpentan-1-ol.

Molecular Properties

Compound Name2-ethyl-4-phenylpentan-1-ol
PubChem CID71626518
Molecular FormulaC13H20O
Molecular Weight192.30 g/mol
Exact Mass192.15
IUPAC Name2-ethyl-4-phenylpentan-1-ol
SMILESCCC(CO)CC(C)c1ccccc1
InChIInChI=1S/C13H20O/c1-3-12(10-14)9-11(2)13-7-5-4-6-8-13/h4-8,11-12,14H,3,9-10H2,1-2H3
InChIKeySYBZRZVYXNPFGS-UHFFFAOYSA-N
XLogP3.20
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.30
LogP ≤ 53.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze 2-ethyl-4-phenylpentan-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-ethyl-4-phenylpentan-1-ol?
The IUPAC name of 2-ethyl-4-phenylpentan-1-ol (CID 71626518) is 2-ethyl-4-phenylpentan-1-ol.
What is the SMILES notation for 2-ethyl-4-phenylpentan-1-ol?
The canonical SMILES for 2-ethyl-4-phenylpentan-1-ol is CCC(CO)CC(C)c1ccccc1.
What is the InChIKey of 2-ethyl-4-phenylpentan-1-ol?
The InChIKey is SYBZRZVYXNPFGS-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20O/c1-3-12(10-14)9-11(2)13-7-5-4-6-8-13/h4-8,11-12,14H,3,9-10H2,1-2H3.
What are the key properties of 2-ethyl-4-phenylpentan-1-ol?
2-ethyl-4-phenylpentan-1-ol has a molecular weight of 192.30 g/mol, XLogP of 3.20, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-4-phenylpentan-1-ol is sourced from PubChem (CID 71626518), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).