2-(3-hydroxypent-1-enylidene)-1,3,3-trimethylcyclopentan-1-ol

C13H22O2 — CID 15713914

IUPAC2-(3-hydroxypent-1-enylidene)-1,3,3-trimethylcyclopentan-1-ol
SMILESCCC(O)C=C=C1C(C)(C)CCC1(C)O
InChIInChI=1S/C13H22O2/c1-5-10(14)6-7-11-12(2,3)8-9-13(11,4)15/h6,10,14-15H,5,8-9H2,1-4H3
InChIKeyUJNLSTQPYIEYKB-UHFFFAOYSA-N
MW210.32 g/mol
LogP2.41
Rot. Bonds2

About 2-(3-hydroxypent-1-enylidene)-1,3,3-trimethylcyclopentan-1-ol

2-(3-hydroxypent-1-enylidene)-1,3,3-trimethylcyclopentan-1-ol (PubChem CID 15713914) has the molecular formula C13H22O2 and a molecular weight of 210.32 g/mol. Its IUPAC name is 2-(3-hydroxypent-1-enylidene)-1,3,3-trimethylcyclopentan-1-ol.

Molecular Properties

Compound Name2-(3-hydroxypent-1-enylidene)-1,3,3-trimethylcyclopentan-1-ol
PubChem CID15713914
Molecular FormulaC13H22O2
Molecular Weight210.32 g/mol
Exact Mass210.16
IUPAC Name2-(3-hydroxypent-1-enylidene)-1,3,3-trimethylcyclopentan-1-ol
SMILESCCC(O)C=C=C1C(C)(C)CCC1(C)O
InChIInChI=1S/C13H22O2/c1-5-10(14)6-7-11-12(2,3)8-9-13(11,4)15/h6,10,14-15H,5,8-9H2,1-4H3
InChIKeyUJNLSTQPYIEYKB-UHFFFAOYSA-N
XLogP2.41
TPSA40.46 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.32
LogP ≤ 52.41
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 2-(3-hydroxypent-1-enylidene)-1,3,3-trimethylcyclopentan-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-(3-hydroxypent-1-enylidene)-1,3,3-trimethylcyclopentan-1-ol?
The IUPAC name of 2-(3-hydroxypent-1-enylidene)-1,3,3-trimethylcyclopentan-1-ol (CID 15713914) is 2-(3-hydroxypent-1-enylidene)-1,3,3-trimethylcyclopentan-1-ol.
What is the SMILES notation for 2-(3-hydroxypent-1-enylidene)-1,3,3-trimethylcyclopentan-1-ol?
The canonical SMILES for 2-(3-hydroxypent-1-enylidene)-1,3,3-trimethylcyclopentan-1-ol is CCC(O)C=C=C1C(C)(C)CCC1(C)O.
What is the InChIKey of 2-(3-hydroxypent-1-enylidene)-1,3,3-trimethylcyclopentan-1-ol?
The InChIKey is UJNLSTQPYIEYKB-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22O2/c1-5-10(14)6-7-11-12(2,3)8-9-13(11,4)15/h6,10,14-15H,5,8-9H2,1-4H3.
What are the key properties of 2-(3-hydroxypent-1-enylidene)-1,3,3-trimethylcyclopentan-1-ol?
2-(3-hydroxypent-1-enylidene)-1,3,3-trimethylcyclopentan-1-ol has a molecular weight of 210.32 g/mol, XLogP of 2.41, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-hydroxypent-1-enylidene)-1,3,3-trimethylcyclopentan-1-ol is sourced from PubChem (CID 15713914), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).