1-methyl-2-(2-methylcyclohexyl)oxybenzene

C14H20O — CID 139448709

IUPAC1-methyl-2-(2-methylcyclohexyl)oxybenzene
SMILESCc1ccccc1OC1CCCCC1C
InChIInChI=1S/C14H20O/c1-11-7-3-5-9-13(11)15-14-10-6-4-8-12(14)2/h3,5,7,9,12,14H,4,6,8,10H2,1-2H3
InChIKeyCJKAQMDSLHAICD-UHFFFAOYSA-N
MW204.31 g/mol
LogP3.95
Rot. Bonds2

About 1-methyl-2-(2-methylcyclohexyl)oxybenzene

1-methyl-2-(2-methylcyclohexyl)oxybenzene (PubChem CID 139448709) has the molecular formula C14H20O and a molecular weight of 204.31 g/mol. Its IUPAC name is 1-methyl-2-(2-methylcyclohexyl)oxybenzene.

Molecular Properties

Compound Name1-methyl-2-(2-methylcyclohexyl)oxybenzene
PubChem CID139448709
Molecular FormulaC14H20O
Molecular Weight204.31 g/mol
Exact Mass204.15
IUPAC Name1-methyl-2-(2-methylcyclohexyl)oxybenzene
SMILESCc1ccccc1OC1CCCCC1C
InChIInChI=1S/C14H20O/c1-11-7-3-5-9-13(11)15-14-10-6-4-8-12(14)2/h3,5,7,9,12,14H,4,6,8,10H2,1-2H3
InChIKeyCJKAQMDSLHAICD-UHFFFAOYSA-N
XLogP3.95
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.31
LogP ≤ 53.95
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 1-methyl-2-(2-methylcyclohexyl)oxybenzene?
The IUPAC name of 1-methyl-2-(2-methylcyclohexyl)oxybenzene (CID 139448709) is 1-methyl-2-(2-methylcyclohexyl)oxybenzene.
What is the SMILES notation for 1-methyl-2-(2-methylcyclohexyl)oxybenzene?
The canonical SMILES for 1-methyl-2-(2-methylcyclohexyl)oxybenzene is Cc1ccccc1OC1CCCCC1C.
What is the InChIKey of 1-methyl-2-(2-methylcyclohexyl)oxybenzene?
The InChIKey is CJKAQMDSLHAICD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20O/c1-11-7-3-5-9-13(11)15-14-10-6-4-8-12(14)2/h3,5,7,9,12,14H,4,6,8,10H2,1-2H3.
What are the key properties of 1-methyl-2-(2-methylcyclohexyl)oxybenzene?
1-methyl-2-(2-methylcyclohexyl)oxybenzene has a molecular weight of 204.31 g/mol, XLogP of 3.95, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-2-(2-methylcyclohexyl)oxybenzene is sourced from PubChem (CID 139448709), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).