(5Z)-4-methylidene-5-prop-2-enylidenecyclohexane-1,3-diol

C10H14O2 — CID 59883743

IUPAC(5Z)-4-methylidene-5-prop-2-enylidenecyclohexane-1,3-diol
SMILESC=C/C=C1/CC(O)CC(O)C1=C
InChIInChI=1S/C10H14O2/c1-3-4-8-5-9(11)6-10(12)7(8)2/h3-4,9-12H,1-2,5-6H2/b8-4-
InChIKeyITISOZQEKJQOQF-YWEYNIOJSA-N
MW166.22 g/mol
LogP1.17
Rot. Bonds1

About (5Z)-4-methylidene-5-prop-2-enylidenecyclohexane-1,3-diol

(5Z)-4-methylidene-5-prop-2-enylidenecyclohexane-1,3-diol (PubChem CID 59883743) has the molecular formula C10H14O2 and a molecular weight of 166.22 g/mol. Its IUPAC name is (5Z)-4-methylidene-5-prop-2-enylidenecyclohexane-1,3-diol.

Molecular Properties

Compound Name(5Z)-4-methylidene-5-prop-2-enylidenecyclohexane-1,3-diol
PubChem CID59883743
Molecular FormulaC10H14O2
Molecular Weight166.22 g/mol
Exact Mass166.10
IUPAC Name(5Z)-4-methylidene-5-prop-2-enylidenecyclohexane-1,3-diol
SMILESC=C/C=C1/CC(O)CC(O)C1=C
InChIInChI=1S/C10H14O2/c1-3-4-8-5-9(11)6-10(12)7(8)2/h3-4,9-12H,1-2,5-6H2/b8-4-
InChIKeyITISOZQEKJQOQF-YWEYNIOJSA-N
XLogP1.17
TPSA40.46 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500166.22
LogP ≤ 51.17
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze (5Z)-4-methylidene-5-prop-2-enylidenecyclohexane-1,3-diol 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 (5Z)-4-methylidene-5-prop-2-enylidenecyclohexane-1,3-diol?
The IUPAC name of (5Z)-4-methylidene-5-prop-2-enylidenecyclohexane-1,3-diol (CID 59883743) is (5Z)-4-methylidene-5-prop-2-enylidenecyclohexane-1,3-diol.
What is the SMILES notation for (5Z)-4-methylidene-5-prop-2-enylidenecyclohexane-1,3-diol?
The canonical SMILES for (5Z)-4-methylidene-5-prop-2-enylidenecyclohexane-1,3-diol is C=C/C=C1/CC(O)CC(O)C1=C.
What is the InChIKey of (5Z)-4-methylidene-5-prop-2-enylidenecyclohexane-1,3-diol?
The InChIKey is ITISOZQEKJQOQF-YWEYNIOJSA-N. The full InChI is InChI=1S/C10H14O2/c1-3-4-8-5-9(11)6-10(12)7(8)2/h3-4,9-12H,1-2,5-6H2/b8-4-.
What are the key properties of (5Z)-4-methylidene-5-prop-2-enylidenecyclohexane-1,3-diol?
(5Z)-4-methylidene-5-prop-2-enylidenecyclohexane-1,3-diol has a molecular weight of 166.22 g/mol, XLogP of 1.17, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (5Z)-4-methylidene-5-prop-2-enylidenecyclohexane-1,3-diol is sourced from PubChem (CID 59883743), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).