4-(3-cyclopentylcyclopentyl)phenol

C16H22O — CID 57025920

IUPAC4-(3-cyclopentylcyclopentyl)phenol
SMILESOc1ccc(C2CCC(C3CCCC3)C2)cc1
InChIInChI=1S/C16H22O/c17-16-9-7-13(8-10-16)15-6-5-14(11-15)12-3-1-2-4-12/h7-10,12,14-15,17H,1-6,11H2
InChIKeyMQIGJVOCSNHNLD-UHFFFAOYSA-N
MW230.35 g/mol
LogP4.47
Rot. Bonds2

About 4-(3-cyclopentylcyclopentyl)phenol

4-(3-cyclopentylcyclopentyl)phenol (PubChem CID 57025920) has the molecular formula C16H22O and a molecular weight of 230.35 g/mol. Its IUPAC name is 4-(3-cyclopentylcyclopentyl)phenol.

Molecular Properties

Compound Name4-(3-cyclopentylcyclopentyl)phenol
PubChem CID57025920
Molecular FormulaC16H22O
Molecular Weight230.35 g/mol
Exact Mass230.17
IUPAC Name4-(3-cyclopentylcyclopentyl)phenol
SMILESOc1ccc(C2CCC(C3CCCC3)C2)cc1
InChIInChI=1S/C16H22O/c17-16-9-7-13(8-10-16)15-6-5-14(11-15)12-3-1-2-4-12/h7-10,12,14-15,17H,1-6,11H2
InChIKeyMQIGJVOCSNHNLD-UHFFFAOYSA-N
XLogP4.47
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.35
LogP ≤ 54.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze 4-(3-cyclopentylcyclopentyl)phenol 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 4-(3-cyclopentylcyclopentyl)phenol?
The IUPAC name of 4-(3-cyclopentylcyclopentyl)phenol (CID 57025920) is 4-(3-cyclopentylcyclopentyl)phenol.
What is the SMILES notation for 4-(3-cyclopentylcyclopentyl)phenol?
The canonical SMILES for 4-(3-cyclopentylcyclopentyl)phenol is Oc1ccc(C2CCC(C3CCCC3)C2)cc1.
What is the InChIKey of 4-(3-cyclopentylcyclopentyl)phenol?
The InChIKey is MQIGJVOCSNHNLD-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22O/c17-16-9-7-13(8-10-16)15-6-5-14(11-15)12-3-1-2-4-12/h7-10,12,14-15,17H,1-6,11H2.
What are the key properties of 4-(3-cyclopentylcyclopentyl)phenol?
4-(3-cyclopentylcyclopentyl)phenol has a molecular weight of 230.35 g/mol, XLogP of 4.47, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3-cyclopentylcyclopentyl)phenol is sourced from PubChem (CID 57025920), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).