2-[4-(2-methylcyclohexyl)phenyl]propan-1-ol

C16H24O — CID 3056655

IUPAC2-[4-(2-methylcyclohexyl)phenyl]propan-1-ol
SMILESCC(CO)c1ccc(C2CCCCC2C)cc1
InChIInChI=1S/C16H24O/c1-12-5-3-4-6-16(12)15-9-7-14(8-10-15)13(2)11-17/h7-10,12-13,16-17H,3-6,11H2,1-2H3
InChIKeySYQJNGUVFHQFQY-UHFFFAOYSA-N
MW232.37 g/mol
LogP4.08
Rot. Bonds3

About 2-[4-(2-methylcyclohexyl)phenyl]propan-1-ol

2-[4-(2-methylcyclohexyl)phenyl]propan-1-ol (PubChem CID 3056655) has the molecular formula C16H24O and a molecular weight of 232.37 g/mol. Its IUPAC name is 2-[4-(2-methylcyclohexyl)phenyl]propan-1-ol.

Molecular Properties

Compound Name2-[4-(2-methylcyclohexyl)phenyl]propan-1-ol
PubChem CID3056655
Molecular FormulaC16H24O
Molecular Weight232.37 g/mol
Exact Mass232.18
IUPAC Name2-[4-(2-methylcyclohexyl)phenyl]propan-1-ol
SMILESCC(CO)c1ccc(C2CCCCC2C)cc1
InChIInChI=1S/C16H24O/c1-12-5-3-4-6-16(12)15-9-7-14(8-10-15)13(2)11-17/h7-10,12-13,16-17H,3-6,11H2,1-2H3
InChIKeySYQJNGUVFHQFQY-UHFFFAOYSA-N
XLogP4.08
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 ≤ 54.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-[4-(2-methylcyclohexyl)phenyl]propan-1-ol?
The IUPAC name of 2-[4-(2-methylcyclohexyl)phenyl]propan-1-ol (CID 3056655) is 2-[4-(2-methylcyclohexyl)phenyl]propan-1-ol.
What is the SMILES notation for 2-[4-(2-methylcyclohexyl)phenyl]propan-1-ol?
The canonical SMILES for 2-[4-(2-methylcyclohexyl)phenyl]propan-1-ol is CC(CO)c1ccc(C2CCCCC2C)cc1.
What is the InChIKey of 2-[4-(2-methylcyclohexyl)phenyl]propan-1-ol?
The InChIKey is SYQJNGUVFHQFQY-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24O/c1-12-5-3-4-6-16(12)15-9-7-14(8-10-15)13(2)11-17/h7-10,12-13,16-17H,3-6,11H2,1-2H3.
What are the key properties of 2-[4-(2-methylcyclohexyl)phenyl]propan-1-ol?
2-[4-(2-methylcyclohexyl)phenyl]propan-1-ol has a molecular weight of 232.37 g/mol, XLogP of 4.08, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(2-methylcyclohexyl)phenyl]propan-1-ol is sourced from PubChem (CID 3056655), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).