4-methyl-2-(3-methylphenoxy)-1,2,3,4-tetrahydronaphthalen-1-ol

C18H20O2 — CID 115420154

IUPAC4-methyl-2-(3-methylphenoxy)-1,2,3,4-tetrahydronaphthalen-1-ol
SMILESCc1cccc(OC2CC(C)c3ccccc3C2O)c1
InChIInChI=1S/C18H20O2/c1-12-6-5-7-14(10-12)20-17-11-13(2)15-8-3-4-9-16(15)18(17)19/h3-10,13,17-19H,11H2,1-2H3
InChIKeyZLUXPZLBJGOIKT-UHFFFAOYSA-N
MW268.36 g/mol
LogP3.98
Rot. Bonds2

About 4-methyl-2-(3-methylphenoxy)-1,2,3,4-tetrahydronaphthalen-1-ol

4-methyl-2-(3-methylphenoxy)-1,2,3,4-tetrahydronaphthalen-1-ol (PubChem CID 115420154) has the molecular formula C18H20O2 and a molecular weight of 268.36 g/mol. Its IUPAC name is 4-methyl-2-(3-methylphenoxy)-1,2,3,4-tetrahydronaphthalen-1-ol.

Molecular Properties

Compound Name4-methyl-2-(3-methylphenoxy)-1,2,3,4-tetrahydronaphthalen-1-ol
PubChem CID115420154
Molecular FormulaC18H20O2
Molecular Weight268.36 g/mol
Exact Mass268.15
IUPAC Name4-methyl-2-(3-methylphenoxy)-1,2,3,4-tetrahydronaphthalen-1-ol
SMILESCc1cccc(OC2CC(C)c3ccccc3C2O)c1
InChIInChI=1S/C18H20O2/c1-12-6-5-7-14(10-12)20-17-11-13(2)15-8-3-4-9-16(15)18(17)19/h3-10,13,17-19H,11H2,1-2H3
InChIKeyZLUXPZLBJGOIKT-UHFFFAOYSA-N
XLogP3.98
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.36
LogP ≤ 53.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 4-methyl-2-(3-methylphenoxy)-1,2,3,4-tetrahydronaphthalen-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 4-methyl-2-(3-methylphenoxy)-1,2,3,4-tetrahydronaphthalen-1-ol?
The IUPAC name of 4-methyl-2-(3-methylphenoxy)-1,2,3,4-tetrahydronaphthalen-1-ol (CID 115420154) is 4-methyl-2-(3-methylphenoxy)-1,2,3,4-tetrahydronaphthalen-1-ol.
What is the SMILES notation for 4-methyl-2-(3-methylphenoxy)-1,2,3,4-tetrahydronaphthalen-1-ol?
The canonical SMILES for 4-methyl-2-(3-methylphenoxy)-1,2,3,4-tetrahydronaphthalen-1-ol is Cc1cccc(OC2CC(C)c3ccccc3C2O)c1.
What is the InChIKey of 4-methyl-2-(3-methylphenoxy)-1,2,3,4-tetrahydronaphthalen-1-ol?
The InChIKey is ZLUXPZLBJGOIKT-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20O2/c1-12-6-5-7-14(10-12)20-17-11-13(2)15-8-3-4-9-16(15)18(17)19/h3-10,13,17-19H,11H2,1-2H3.
What are the key properties of 4-methyl-2-(3-methylphenoxy)-1,2,3,4-tetrahydronaphthalen-1-ol?
4-methyl-2-(3-methylphenoxy)-1,2,3,4-tetrahydronaphthalen-1-ol has a molecular weight of 268.36 g/mol, XLogP of 3.98, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-2-(3-methylphenoxy)-1,2,3,4-tetrahydronaphthalen-1-ol is sourced from PubChem (CID 115420154), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).