cyclohexylmethoxybenzene

C13H18O — CID 14399287

IUPACcyclohexylmethoxybenzene
SMILESc1ccc(OCC2CCCCC2)cc1
InChIInChI=1S/C13H18O/c1-3-7-12(8-4-1)11-14-13-9-5-2-6-10-13/h2,5-6,9-10,12H,1,3-4,7-8,11H2
InChIKeyZETPYKRXIXPMQA-UHFFFAOYSA-N
MW190.29 g/mol
LogP3.65
Rot. Bonds3

About cyclohexylmethoxybenzene

cyclohexylmethoxybenzene (PubChem CID 14399287) has the molecular formula C13H18O and a molecular weight of 190.29 g/mol. Its IUPAC name is cyclohexylmethoxybenzene.

Molecular Properties

Compound Namecyclohexylmethoxybenzene
PubChem CID14399287
Molecular FormulaC13H18O
Molecular Weight190.29 g/mol
Exact Mass190.14
IUPAC Namecyclohexylmethoxybenzene
SMILESc1ccc(OCC2CCCCC2)cc1
InChIInChI=1S/C13H18O/c1-3-7-12(8-4-1)11-14-13-9-5-2-6-10-13/h2,5-6,9-10,12H,1,3-4,7-8,11H2
InChIKeyZETPYKRXIXPMQA-UHFFFAOYSA-N
XLogP3.65
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.29
LogP ≤ 53.65
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze cyclohexylmethoxybenzene 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

cyclopropylmethoxybenzene
CID 12712156
1-(cyclohexylmethoxy)-4-phenylbenzene
CID 59950067
1-(cyclohexylmethoxy)-3-fluorobenzene
CID 60731171
(3S)-3-(phenoxymethyl)piperidine
CID 26190643
(4-ethylphenoxy)methylcycloheptane
CID 142027305
1-(cyclohexylmethoxy)-4-ethylbenzene
CID 58865018
3-(cyclooctylmethoxy)benzoic acid
CID 58347494
(1S,5R)-3-(phenoxymethyl)bicyclo[3.2.1]octane
CID 70660865
(4-prop-2-enylcyclohexyl)methoxybenzene
CID 70544247
1-(cyclohexylmethoxy)-3-ethylbenzene
CID 64765854
[3-(cyclohexylmethoxy)phenyl]-trifluoroboranuide
CID 55232578
(3-propoxyphenoxy)methylcyclooctane
CID 69097441

Frequently Asked Questions

What is the IUPAC name of cyclohexylmethoxybenzene?
The IUPAC name of cyclohexylmethoxybenzene (CID 14399287) is cyclohexylmethoxybenzene.
What is the SMILES notation for cyclohexylmethoxybenzene?
The canonical SMILES for cyclohexylmethoxybenzene is c1ccc(OCC2CCCCC2)cc1.
What is the InChIKey of cyclohexylmethoxybenzene?
The InChIKey is ZETPYKRXIXPMQA-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18O/c1-3-7-12(8-4-1)11-14-13-9-5-2-6-10-13/h2,5-6,9-10,12H,1,3-4,7-8,11H2.
What are the key properties of cyclohexylmethoxybenzene?
cyclohexylmethoxybenzene has a molecular weight of 190.29 g/mol, XLogP of 3.65, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for cyclohexylmethoxybenzene is sourced from PubChem (CID 14399287), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).