1-[(3Z)-cyclooct-3-en-1-yl]propan-1-ol

C11H20O — CID 66934567

IUPAC1-[(3Z)-cyclooct-3-en-1-yl]propan-1-ol
SMILESCCC(O)C1C/C=C\CCCC1
InChIInChI=1S/C11H20O/c1-2-11(12)10-8-6-4-3-5-7-9-10/h4,6,10-12H,2-3,5,7-9H2,1H3/b6-4-
InChIKeyLLYJRIQMURUPPF-XQRVVYSFSA-N
MW168.28 g/mol
LogP2.89
Rot. Bonds2

About 1-[(3Z)-cyclooct-3-en-1-yl]propan-1-ol

1-[(3Z)-cyclooct-3-en-1-yl]propan-1-ol (PubChem CID 66934567) has the molecular formula C11H20O and a molecular weight of 168.28 g/mol. Its IUPAC name is 1-[(3Z)-cyclooct-3-en-1-yl]propan-1-ol.

Molecular Properties

Compound Name1-[(3Z)-cyclooct-3-en-1-yl]propan-1-ol
PubChem CID66934567
Molecular FormulaC11H20O
Molecular Weight168.28 g/mol
Exact Mass168.15
IUPAC Name1-[(3Z)-cyclooct-3-en-1-yl]propan-1-ol
SMILESCCC(O)C1C/C=C\CCCC1
InChIInChI=1S/C11H20O/c1-2-11(12)10-8-6-4-3-5-7-9-10/h4,6,10-12H,2-3,5,7-9H2,1H3/b6-4-
InChIKeyLLYJRIQMURUPPF-XQRVVYSFSA-N
XLogP2.89
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.28
LogP ≤ 52.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze 1-[(3Z)-cyclooct-3-en-1-yl]propan-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 1-[(3Z)-cyclooct-3-en-1-yl]propan-1-ol?
The IUPAC name of 1-[(3Z)-cyclooct-3-en-1-yl]propan-1-ol (CID 66934567) is 1-[(3Z)-cyclooct-3-en-1-yl]propan-1-ol.
What is the SMILES notation for 1-[(3Z)-cyclooct-3-en-1-yl]propan-1-ol?
The canonical SMILES for 1-[(3Z)-cyclooct-3-en-1-yl]propan-1-ol is CCC(O)C1C/C=C\CCCC1.
What is the InChIKey of 1-[(3Z)-cyclooct-3-en-1-yl]propan-1-ol?
The InChIKey is LLYJRIQMURUPPF-XQRVVYSFSA-N. The full InChI is InChI=1S/C11H20O/c1-2-11(12)10-8-6-4-3-5-7-9-10/h4,6,10-12H,2-3,5,7-9H2,1H3/b6-4-.
What are the key properties of 1-[(3Z)-cyclooct-3-en-1-yl]propan-1-ol?
1-[(3Z)-cyclooct-3-en-1-yl]propan-1-ol has a molecular weight of 168.28 g/mol, XLogP of 2.89, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(3Z)-cyclooct-3-en-1-yl]propan-1-ol is sourced from PubChem (CID 66934567), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).