2-cyclopentyl-4-methyl-6-(2-methylpropyl)phenol

C16H24O — CID 3022613

IUPAC2-cyclopentyl-4-methyl-6-(2-methylpropyl)phenol
SMILESCc1cc(CC(C)C)c(O)c(C2CCCC2)c1
InChIInChI=1S/C16H24O/c1-11(2)8-14-9-12(3)10-15(16(14)17)13-6-4-5-7-13/h9-11,13,17H,4-8H2,1-3H3
InChIKeyGIAQITHFOGVYNA-UHFFFAOYSA-N
MW232.37 g/mol
LogP4.56
Rot. Bonds3

About 2-cyclopentyl-4-methyl-6-(2-methylpropyl)phenol

2-cyclopentyl-4-methyl-6-(2-methylpropyl)phenol (PubChem CID 3022613) has the molecular formula C16H24O and a molecular weight of 232.37 g/mol. Its IUPAC name is 2-cyclopentyl-4-methyl-6-(2-methylpropyl)phenol.

Molecular Properties

Compound Name2-cyclopentyl-4-methyl-6-(2-methylpropyl)phenol
PubChem CID3022613
Molecular FormulaC16H24O
Molecular Weight232.37 g/mol
Exact Mass232.18
IUPAC Name2-cyclopentyl-4-methyl-6-(2-methylpropyl)phenol
SMILESCc1cc(CC(C)C)c(O)c(C2CCCC2)c1
InChIInChI=1S/C16H24O/c1-11(2)8-14-9-12(3)10-15(16(14)17)13-6-4-5-7-13/h9-11,13,17H,4-8H2,1-3H3
InChIKeyGIAQITHFOGVYNA-UHFFFAOYSA-N
XLogP4.56
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.37
LogP ≤ 54.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-cyclopentyl-4-methyl-6-(2-methylpropyl)phenol?
The IUPAC name of 2-cyclopentyl-4-methyl-6-(2-methylpropyl)phenol (CID 3022613) is 2-cyclopentyl-4-methyl-6-(2-methylpropyl)phenol.
What is the SMILES notation for 2-cyclopentyl-4-methyl-6-(2-methylpropyl)phenol?
The canonical SMILES for 2-cyclopentyl-4-methyl-6-(2-methylpropyl)phenol is Cc1cc(CC(C)C)c(O)c(C2CCCC2)c1.
What is the InChIKey of 2-cyclopentyl-4-methyl-6-(2-methylpropyl)phenol?
The InChIKey is GIAQITHFOGVYNA-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24O/c1-11(2)8-14-9-12(3)10-15(16(14)17)13-6-4-5-7-13/h9-11,13,17H,4-8H2,1-3H3.
What are the key properties of 2-cyclopentyl-4-methyl-6-(2-methylpropyl)phenol?
2-cyclopentyl-4-methyl-6-(2-methylpropyl)phenol has a molecular weight of 232.37 g/mol, XLogP of 4.56, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopentyl-4-methyl-6-(2-methylpropyl)phenol is sourced from PubChem (CID 3022613), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).