(E)-4-ethyltetradec-3-en-2-ol

C16H32O — CID 101429656

IUPAC(E)-4-ethyltetradec-3-en-2-ol
SMILESCCCCCCCCCC/C(=C/C(C)O)CC
InChIInChI=1S/C16H32O/c1-4-6-7-8-9-10-11-12-13-16(5-2)14-15(3)17/h14-15,17H,4-13H2,1-3H3/b16-14+
InChIKeyFURADOYOECYXNV-JQIJEIRASA-N
MW240.43 g/mol
LogP5.23
Rot. Bonds11

About (E)-4-ethyltetradec-3-en-2-ol

(E)-4-ethyltetradec-3-en-2-ol (PubChem CID 101429656) has the molecular formula C16H32O and a molecular weight of 240.43 g/mol. Its IUPAC name is (E)-4-ethyltetradec-3-en-2-ol.

Molecular Properties

Compound Name(E)-4-ethyltetradec-3-en-2-ol
PubChem CID101429656
Molecular FormulaC16H32O
Molecular Weight240.43 g/mol
Exact Mass240.25
IUPAC Name(E)-4-ethyltetradec-3-en-2-ol
SMILESCCCCCCCCCC/C(=C/C(C)O)CC
InChIInChI=1S/C16H32O/c1-4-6-7-8-9-10-11-12-13-16(5-2)14-15(3)17/h14-15,17H,4-13H2,1-3H3/b16-14+
InChIKeyFURADOYOECYXNV-JQIJEIRASA-N
XLogP5.23
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds11
Heavy Atoms17
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500240.43
LogP ≤ 55.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze (E)-4-ethyltetradec-3-en-2-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 (E)-4-ethyltetradec-3-en-2-ol?
The IUPAC name of (E)-4-ethyltetradec-3-en-2-ol (CID 101429656) is (E)-4-ethyltetradec-3-en-2-ol.
What is the SMILES notation for (E)-4-ethyltetradec-3-en-2-ol?
The canonical SMILES for (E)-4-ethyltetradec-3-en-2-ol is CCCCCCCCCC/C(=C/C(C)O)CC.
What is the InChIKey of (E)-4-ethyltetradec-3-en-2-ol?
The InChIKey is FURADOYOECYXNV-JQIJEIRASA-N. The full InChI is InChI=1S/C16H32O/c1-4-6-7-8-9-10-11-12-13-16(5-2)14-15(3)17/h14-15,17H,4-13H2,1-3H3/b16-14+.
What are the key properties of (E)-4-ethyltetradec-3-en-2-ol?
(E)-4-ethyltetradec-3-en-2-ol has a molecular weight of 240.43 g/mol, XLogP of 5.23, 11 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-4-ethyltetradec-3-en-2-ol is sourced from PubChem (CID 101429656), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).