5-methyl-2-(3-methylcyclohexen-1-yl)-3-propan-2-yloxyphenol

C17H24O2 — CID 155737190

IUPAC5-methyl-2-(3-methylcyclohexen-1-yl)-3-propan-2-yloxyphenol
SMILESCc1cc(O)c(C2=CC(C)CCC2)c(OC(C)C)c1
InChIInChI=1S/C17H24O2/c1-11(2)19-16-10-13(4)9-15(18)17(16)14-7-5-6-12(3)8-14/h8-12,18H,5-7H2,1-4H3
InChIKeyDMIRXZQPUMBFJH-UHFFFAOYSA-N
MW260.38 g/mol
LogP4.69
Rot. Bonds3

About 5-methyl-2-(3-methylcyclohexen-1-yl)-3-propan-2-yloxyphenol

5-methyl-2-(3-methylcyclohexen-1-yl)-3-propan-2-yloxyphenol (PubChem CID 155737190) has the molecular formula C17H24O2 and a molecular weight of 260.38 g/mol. Its IUPAC name is 5-methyl-2-(3-methylcyclohexen-1-yl)-3-propan-2-yloxyphenol.

Molecular Properties

Compound Name5-methyl-2-(3-methylcyclohexen-1-yl)-3-propan-2-yloxyphenol
PubChem CID155737190
Molecular FormulaC17H24O2
Molecular Weight260.38 g/mol
Exact Mass260.18
IUPAC Name5-methyl-2-(3-methylcyclohexen-1-yl)-3-propan-2-yloxyphenol
SMILESCc1cc(O)c(C2=CC(C)CCC2)c(OC(C)C)c1
InChIInChI=1S/C17H24O2/c1-11(2)19-16-10-13(4)9-15(18)17(16)14-7-5-6-12(3)8-14/h8-12,18H,5-7H2,1-4H3
InChIKeyDMIRXZQPUMBFJH-UHFFFAOYSA-N
XLogP4.69
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.38
LogP ≤ 54.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 5-methyl-2-(3-methylcyclohexen-1-yl)-3-propan-2-yloxyphenol 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-methyl-2-(3-methylcyclohexen-1-yl)-3-propan-2-yloxyphenol?
The IUPAC name of 5-methyl-2-(3-methylcyclohexen-1-yl)-3-propan-2-yloxyphenol (CID 155737190) is 5-methyl-2-(3-methylcyclohexen-1-yl)-3-propan-2-yloxyphenol.
What is the SMILES notation for 5-methyl-2-(3-methylcyclohexen-1-yl)-3-propan-2-yloxyphenol?
The canonical SMILES for 5-methyl-2-(3-methylcyclohexen-1-yl)-3-propan-2-yloxyphenol is Cc1cc(O)c(C2=CC(C)CCC2)c(OC(C)C)c1.
What is the InChIKey of 5-methyl-2-(3-methylcyclohexen-1-yl)-3-propan-2-yloxyphenol?
The InChIKey is DMIRXZQPUMBFJH-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24O2/c1-11(2)19-16-10-13(4)9-15(18)17(16)14-7-5-6-12(3)8-14/h8-12,18H,5-7H2,1-4H3.
What are the key properties of 5-methyl-2-(3-methylcyclohexen-1-yl)-3-propan-2-yloxyphenol?
5-methyl-2-(3-methylcyclohexen-1-yl)-3-propan-2-yloxyphenol has a molecular weight of 260.38 g/mol, XLogP of 4.69, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-2-(3-methylcyclohexen-1-yl)-3-propan-2-yloxyphenol is sourced from PubChem (CID 155737190), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).