3-methyl-1,2,3,4-tetrahydronaphthalen-1-ol

C11H14O — CID 582249

IUPAC3-methyl-1,2,3,4-tetrahydronaphthalen-1-ol
SMILESCC1Cc2ccccc2C(O)C1
InChIInChI=1S/C11H14O/c1-8-6-9-4-2-3-5-10(9)11(12)7-8/h2-5,8,11-12H,6-7H2,1H3
InChIKeyQWNQGLDZMQCYLU-UHFFFAOYSA-N
MW162.23 g/mol
LogP2.30
Rot. Bonds

About 3-methyl-1,2,3,4-tetrahydronaphthalen-1-ol

3-methyl-1,2,3,4-tetrahydronaphthalen-1-ol (PubChem CID 582249) has the molecular formula C11H14O and a molecular weight of 162.23 g/mol. Its IUPAC name is 3-methyl-1,2,3,4-tetrahydronaphthalen-1-ol.

Molecular Properties

Compound Name3-methyl-1,2,3,4-tetrahydronaphthalen-1-ol
PubChem CID582249
Molecular FormulaC11H14O
Molecular Weight162.23 g/mol
Exact Mass162.10
IUPAC Name3-methyl-1,2,3,4-tetrahydronaphthalen-1-ol
SMILESCC1Cc2ccccc2C(O)C1
InChIInChI=1S/C11H14O/c1-8-6-9-4-2-3-5-10(9)11(12)7-8/h2-5,8,11-12H,6-7H2,1H3
InChIKeyQWNQGLDZMQCYLU-UHFFFAOYSA-N
XLogP2.30
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms12
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500162.23
LogP ≤ 52.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 3-methyl-1,2,3,4-tetrahydronaphthalen-1-ol?
The IUPAC name of 3-methyl-1,2,3,4-tetrahydronaphthalen-1-ol (CID 582249) is 3-methyl-1,2,3,4-tetrahydronaphthalen-1-ol.
What is the SMILES notation for 3-methyl-1,2,3,4-tetrahydronaphthalen-1-ol?
The canonical SMILES for 3-methyl-1,2,3,4-tetrahydronaphthalen-1-ol is CC1Cc2ccccc2C(O)C1.
What is the InChIKey of 3-methyl-1,2,3,4-tetrahydronaphthalen-1-ol?
The InChIKey is QWNQGLDZMQCYLU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14O/c1-8-6-9-4-2-3-5-10(9)11(12)7-8/h2-5,8,11-12H,6-7H2,1H3.
What are the key properties of 3-methyl-1,2,3,4-tetrahydronaphthalen-1-ol?
3-methyl-1,2,3,4-tetrahydronaphthalen-1-ol has a molecular weight of 162.23 g/mol, XLogP of 2.30, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-1,2,3,4-tetrahydronaphthalen-1-ol is sourced from PubChem (CID 582249), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).