cyclohexane;2-methylphenol

C13H20O — CID 70504255

IUPACcyclohexane;2-methylphenol
SMILESC1CCCCC1.Cc1ccccc1O
InChIInChI=1S/C7H8O.C6H12/c1-6-4-2-3-5-7(6)8;1-2-4-6-5-3-1/h2-5,8H,1H3;1-6H2
InChIKeySDODBBIOUMNXDH-UHFFFAOYSA-N
MW192.30 g/mol
LogP4.04
Rot. Bonds

About cyclohexane;2-methylphenol

cyclohexane;2-methylphenol (PubChem CID 70504255) has the molecular formula C13H20O and a molecular weight of 192.30 g/mol. Its IUPAC name is cyclohexane;2-methylphenol.

Molecular Properties

Compound Namecyclohexane;2-methylphenol
PubChem CID70504255
Molecular FormulaC13H20O
Molecular Weight192.30 g/mol
Exact Mass192.15
IUPAC Namecyclohexane;2-methylphenol
SMILESC1CCCCC1.Cc1ccccc1O
InChIInChI=1S/C7H8O.C6H12/c1-6-4-2-3-5-7(6)8;1-2-4-6-5-3-1/h2-5,8H,1H3;1-6H2
InChIKeySDODBBIOUMNXDH-UHFFFAOYSA-N
XLogP4.04
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.30
LogP ≤ 54.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze cyclohexane;2-methylphenol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

ethane;2-methylphenol
CID 54326461
zinc 2-methylphenol
CID 10374903
hydrazine;2-methylphenol
CID 174667823
methanamine;2-methylphenol
CID 19359053
N-cyclohexylidenehydroxylamine;2-methylphenol
CID 87432171
bicyclo[2.2.0]hexane;2-methylphenol
CID 70270584
hydroperoxymethane;2-methylphenol
CID 87131667
1,2-dichlorobenzene;2-methylphenol
CID 159780398
2,3-dimethylphenol;bis(2-methylphenol)
CID 67655814
ethanol;bis(2-methylphenol);titanium
CID 22238726
benzene-1,2-diol;cyclohexane
CID 175415805
2-methylphenol;thiophene
CID 158862587

Frequently Asked Questions

What is the IUPAC name of cyclohexane;2-methylphenol?
The IUPAC name of cyclohexane;2-methylphenol (CID 70504255) is cyclohexane;2-methylphenol.
What is the SMILES notation for cyclohexane;2-methylphenol?
The canonical SMILES for cyclohexane;2-methylphenol is C1CCCCC1.Cc1ccccc1O.
What is the InChIKey of cyclohexane;2-methylphenol?
The InChIKey is SDODBBIOUMNXDH-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H8O.C6H12/c1-6-4-2-3-5-7(6)8;1-2-4-6-5-3-1/h2-5,8H,1H3;1-6H2.
What are the key properties of cyclohexane;2-methylphenol?
cyclohexane;2-methylphenol has a molecular weight of 192.30 g/mol, XLogP of 4.04, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for cyclohexane;2-methylphenol is sourced from PubChem (CID 70504255), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).