2-methoxy-5-propan-2-ylidenecyclohex-3-en-1-ol

C10H16O2 — CID 23175216

IUPAC2-methoxy-5-propan-2-ylidenecyclohex-3-en-1-ol
SMILESCOC1C=CC(=C(C)C)CC1O
InChIInChI=1S/C10H16O2/c1-7(2)8-4-5-10(12-3)9(11)6-8/h4-5,9-11H,6H2,1-3H3
InChIKeyXYBRTNJCJDFONT-UHFFFAOYSA-N
MW168.24 g/mol
LogP1.66
Rot. Bonds1

About 2-methoxy-5-propan-2-ylidenecyclohex-3-en-1-ol

2-methoxy-5-propan-2-ylidenecyclohex-3-en-1-ol (PubChem CID 23175216) has the molecular formula C10H16O2 and a molecular weight of 168.24 g/mol. Its IUPAC name is 2-methoxy-5-propan-2-ylidenecyclohex-3-en-1-ol.

Molecular Properties

Compound Name2-methoxy-5-propan-2-ylidenecyclohex-3-en-1-ol
PubChem CID23175216
Molecular FormulaC10H16O2
Molecular Weight168.24 g/mol
Exact Mass168.12
IUPAC Name2-methoxy-5-propan-2-ylidenecyclohex-3-en-1-ol
SMILESCOC1C=CC(=C(C)C)CC1O
InChIInChI=1S/C10H16O2/c1-7(2)8-4-5-10(12-3)9(11)6-8/h4-5,9-11H,6H2,1-3H3
InChIKeyXYBRTNJCJDFONT-UHFFFAOYSA-N
XLogP1.66
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.24
LogP ≤ 51.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 2-methoxy-5-propan-2-ylidenecyclohex-3-en-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-methoxy-5-propan-2-ylidenecyclohex-3-en-1-ol?
The IUPAC name of 2-methoxy-5-propan-2-ylidenecyclohex-3-en-1-ol (CID 23175216) is 2-methoxy-5-propan-2-ylidenecyclohex-3-en-1-ol.
What is the SMILES notation for 2-methoxy-5-propan-2-ylidenecyclohex-3-en-1-ol?
The canonical SMILES for 2-methoxy-5-propan-2-ylidenecyclohex-3-en-1-ol is COC1C=CC(=C(C)C)CC1O.
What is the InChIKey of 2-methoxy-5-propan-2-ylidenecyclohex-3-en-1-ol?
The InChIKey is XYBRTNJCJDFONT-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16O2/c1-7(2)8-4-5-10(12-3)9(11)6-8/h4-5,9-11H,6H2,1-3H3.
What are the key properties of 2-methoxy-5-propan-2-ylidenecyclohex-3-en-1-ol?
2-methoxy-5-propan-2-ylidenecyclohex-3-en-1-ol has a molecular weight of 168.24 g/mol, XLogP of 1.66, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-5-propan-2-ylidenecyclohex-3-en-1-ol is sourced from PubChem (CID 23175216), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).