3-(cyclopentylmethyl)-3-methylcyclopentan-1-ol

C12H22O — CID 116539899

IUPAC3-(cyclopentylmethyl)-3-methylcyclopentan-1-ol
SMILESCC1(CC2CCCC2)CCC(O)C1
InChIInChI=1S/C12H22O/c1-12(7-6-11(13)9-12)8-10-4-2-3-5-10/h10-11,13H,2-9H2,1H3
InChIKeyYIDYRZZKEBTJIX-UHFFFAOYSA-N
MW182.31 g/mol
LogP3.12
Rot. Bonds2

About 3-(cyclopentylmethyl)-3-methylcyclopentan-1-ol

3-(cyclopentylmethyl)-3-methylcyclopentan-1-ol (PubChem CID 116539899) has the molecular formula C12H22O and a molecular weight of 182.31 g/mol. Its IUPAC name is 3-(cyclopentylmethyl)-3-methylcyclopentan-1-ol.

Molecular Properties

Compound Name3-(cyclopentylmethyl)-3-methylcyclopentan-1-ol
PubChem CID116539899
Molecular FormulaC12H22O
Molecular Weight182.31 g/mol
Exact Mass182.17
IUPAC Name3-(cyclopentylmethyl)-3-methylcyclopentan-1-ol
SMILESCC1(CC2CCCC2)CCC(O)C1
InChIInChI=1S/C12H22O/c1-12(7-6-11(13)9-12)8-10-4-2-3-5-10/h10-11,13H,2-9H2,1H3
InChIKeyYIDYRZZKEBTJIX-UHFFFAOYSA-N
XLogP3.12
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.31
LogP ≤ 53.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze 3-(cyclopentylmethyl)-3-methylcyclopentan-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 3-(cyclopentylmethyl)-3-methylcyclopentan-1-ol?
The IUPAC name of 3-(cyclopentylmethyl)-3-methylcyclopentan-1-ol (CID 116539899) is 3-(cyclopentylmethyl)-3-methylcyclopentan-1-ol.
What is the SMILES notation for 3-(cyclopentylmethyl)-3-methylcyclopentan-1-ol?
The canonical SMILES for 3-(cyclopentylmethyl)-3-methylcyclopentan-1-ol is CC1(CC2CCCC2)CCC(O)C1.
What is the InChIKey of 3-(cyclopentylmethyl)-3-methylcyclopentan-1-ol?
The InChIKey is YIDYRZZKEBTJIX-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22O/c1-12(7-6-11(13)9-12)8-10-4-2-3-5-10/h10-11,13H,2-9H2,1H3.
What are the key properties of 3-(cyclopentylmethyl)-3-methylcyclopentan-1-ol?
3-(cyclopentylmethyl)-3-methylcyclopentan-1-ol has a molecular weight of 182.31 g/mol, XLogP of 3.12, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(cyclopentylmethyl)-3-methylcyclopentan-1-ol is sourced from PubChem (CID 116539899), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).