5,5-dimethylcyclopenten-1-ol

C7H12O — CID 100967958

IUPAC5,5-dimethylcyclopenten-1-ol
SMILESCC1(C)CCC=C1O
InChIInChI=1S/C7H12O/c1-7(2)5-3-4-6(7)8/h4,8H,3,5H2,1-2H3
InChIKeyIZJAQYGDSRIJBB-UHFFFAOYSA-N
MW112.17 g/mol
LogP2.25
Rot. Bonds

About 5,5-dimethylcyclopenten-1-ol

5,5-dimethylcyclopenten-1-ol (PubChem CID 100967958) has the molecular formula C7H12O and a molecular weight of 112.17 g/mol. Its IUPAC name is 5,5-dimethylcyclopenten-1-ol.

Molecular Properties

Compound Name5,5-dimethylcyclopenten-1-ol
PubChem CID100967958
Molecular FormulaC7H12O
Molecular Weight112.17 g/mol
Exact Mass112.09
IUPAC Name5,5-dimethylcyclopenten-1-ol
SMILESCC1(C)CCC=C1O
InChIInChI=1S/C7H12O/c1-7(2)5-3-4-6(7)8/h4,8H,3,5H2,1-2H3
InChIKeyIZJAQYGDSRIJBB-UHFFFAOYSA-N
XLogP2.25
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500112.17
LogP ≤ 52.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze 5,5-dimethylcyclopenten-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 5,5-dimethylcyclopenten-1-ol?
The IUPAC name of 5,5-dimethylcyclopenten-1-ol (CID 100967958) is 5,5-dimethylcyclopenten-1-ol.
What is the SMILES notation for 5,5-dimethylcyclopenten-1-ol?
The canonical SMILES for 5,5-dimethylcyclopenten-1-ol is CC1(C)CCC=C1O.
What is the InChIKey of 5,5-dimethylcyclopenten-1-ol?
The InChIKey is IZJAQYGDSRIJBB-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H12O/c1-7(2)5-3-4-6(7)8/h4,8H,3,5H2,1-2H3.
What are the key properties of 5,5-dimethylcyclopenten-1-ol?
5,5-dimethylcyclopenten-1-ol has a molecular weight of 112.17 g/mol, XLogP of 2.25, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5,5-dimethylcyclopenten-1-ol is sourced from PubChem (CID 100967958), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).