1-ethyl-4-(4-methylcyclohexyl)oxybenzene

C15H22O — CID 21137256

IUPAC1-ethyl-4-(4-methylcyclohexyl)oxybenzene
SMILESCCc1ccc(OC2CCC(C)CC2)cc1
InChIInChI=1S/C15H22O/c1-3-13-6-10-15(11-7-13)16-14-8-4-12(2)5-9-14/h6-7,10-12,14H,3-5,8-9H2,1-2H3
InChIKeyMIAJMWIENZIXII-UHFFFAOYSA-N
MW218.34 g/mol
LogP4.21
Rot. Bonds3

About 1-ethyl-4-(4-methylcyclohexyl)oxybenzene

1-ethyl-4-(4-methylcyclohexyl)oxybenzene (PubChem CID 21137256) has the molecular formula C15H22O and a molecular weight of 218.34 g/mol. Its IUPAC name is 1-ethyl-4-(4-methylcyclohexyl)oxybenzene.

Molecular Properties

Compound Name1-ethyl-4-(4-methylcyclohexyl)oxybenzene
PubChem CID21137256
Molecular FormulaC15H22O
Molecular Weight218.34 g/mol
Exact Mass218.17
IUPAC Name1-ethyl-4-(4-methylcyclohexyl)oxybenzene
SMILESCCc1ccc(OC2CCC(C)CC2)cc1
InChIInChI=1S/C15H22O/c1-3-13-6-10-15(11-7-13)16-14-8-4-12(2)5-9-14/h6-7,10-12,14H,3-5,8-9H2,1-2H3
InChIKeyMIAJMWIENZIXII-UHFFFAOYSA-N
XLogP4.21
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.34
LogP ≤ 54.21
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze 1-ethyl-4-(4-methylcyclohexyl)oxybenzene 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 1-ethyl-4-(4-methylcyclohexyl)oxybenzene?
The IUPAC name of 1-ethyl-4-(4-methylcyclohexyl)oxybenzene (CID 21137256) is 1-ethyl-4-(4-methylcyclohexyl)oxybenzene.
What is the SMILES notation for 1-ethyl-4-(4-methylcyclohexyl)oxybenzene?
The canonical SMILES for 1-ethyl-4-(4-methylcyclohexyl)oxybenzene is CCc1ccc(OC2CCC(C)CC2)cc1.
What is the InChIKey of 1-ethyl-4-(4-methylcyclohexyl)oxybenzene?
The InChIKey is MIAJMWIENZIXII-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22O/c1-3-13-6-10-15(11-7-13)16-14-8-4-12(2)5-9-14/h6-7,10-12,14H,3-5,8-9H2,1-2H3.
What are the key properties of 1-ethyl-4-(4-methylcyclohexyl)oxybenzene?
1-ethyl-4-(4-methylcyclohexyl)oxybenzene has a molecular weight of 218.34 g/mol, XLogP of 4.21, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-4-(4-methylcyclohexyl)oxybenzene is sourced from PubChem (CID 21137256), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).