14-(2-hydroxyethoxy)tetradec-2-en-4-ol

C16H32O3 — CID 57035567

IUPAC14-(2-hydroxyethoxy)tetradec-2-en-4-ol
SMILESCC=CC(O)CCCCCCCCCCOCCO
InChIInChI=1S/C16H32O3/c1-2-11-16(18)12-9-7-5-3-4-6-8-10-14-19-15-13-17/h2,11,16-18H,3-10,12-15H2,1H3
InChIKeyJZKAYWIJBHBNOH-UHFFFAOYSA-N
MW272.43 g/mol
LogP3.44
Rot. Bonds14

About 14-(2-hydroxyethoxy)tetradec-2-en-4-ol

14-(2-hydroxyethoxy)tetradec-2-en-4-ol (PubChem CID 57035567) has the molecular formula C16H32O3 and a molecular weight of 272.43 g/mol. Its IUPAC name is 14-(2-hydroxyethoxy)tetradec-2-en-4-ol.

Molecular Properties

Compound Name14-(2-hydroxyethoxy)tetradec-2-en-4-ol
PubChem CID57035567
Molecular FormulaC16H32O3
Molecular Weight272.43 g/mol
Exact Mass272.24
IUPAC Name14-(2-hydroxyethoxy)tetradec-2-en-4-ol
SMILESCC=CC(O)CCCCCCCCCCOCCO
InChIInChI=1S/C16H32O3/c1-2-11-16(18)12-9-7-5-3-4-6-8-10-14-19-15-13-17/h2,11,16-18H,3-10,12-15H2,1H3
InChIKeyJZKAYWIJBHBNOH-UHFFFAOYSA-N
XLogP3.44
TPSA49.69 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds14
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.43
LogP ≤ 53.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze 14-(2-hydroxyethoxy)tetradec-2-en-4-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 14-(2-hydroxyethoxy)tetradec-2-en-4-ol?
The IUPAC name of 14-(2-hydroxyethoxy)tetradec-2-en-4-ol (CID 57035567) is 14-(2-hydroxyethoxy)tetradec-2-en-4-ol.
What is the SMILES notation for 14-(2-hydroxyethoxy)tetradec-2-en-4-ol?
The canonical SMILES for 14-(2-hydroxyethoxy)tetradec-2-en-4-ol is CC=CC(O)CCCCCCCCCCOCCO.
What is the InChIKey of 14-(2-hydroxyethoxy)tetradec-2-en-4-ol?
The InChIKey is JZKAYWIJBHBNOH-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H32O3/c1-2-11-16(18)12-9-7-5-3-4-6-8-10-14-19-15-13-17/h2,11,16-18H,3-10,12-15H2,1H3.
What are the key properties of 14-(2-hydroxyethoxy)tetradec-2-en-4-ol?
14-(2-hydroxyethoxy)tetradec-2-en-4-ol has a molecular weight of 272.43 g/mol, XLogP of 3.44, 14 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 14-(2-hydroxyethoxy)tetradec-2-en-4-ol is sourced from PubChem (CID 57035567), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).