1-[4-ethyl-1-(2-propylphenyl)cyclohexyl]-2-propylbenzene

C26H36 — CID 22420606

IUPAC1-[4-ethyl-1-(2-propylphenyl)cyclohexyl]-2-propylbenzene
SMILESCCCc1ccccc1C1(c2ccccc2CCC)CCC(CC)CC1
InChIInChI=1S/C26H36/c1-4-11-22-13-7-9-15-24(22)26(19-17-21(6-3)18-20-26)25-16-10-8-14-23(25)12-5-2/h7-10,13-16,21H,4-6,11-12,17-20H2,1-3H3
InChIKeyFUDLWTYSXOAVBV-UHFFFAOYSA-N
MW348.57 g/mol
LogP7.48
Rot. Bonds7

About 1-[4-ethyl-1-(2-propylphenyl)cyclohexyl]-2-propylbenzene

1-[4-ethyl-1-(2-propylphenyl)cyclohexyl]-2-propylbenzene (PubChem CID 22420606) has the molecular formula C26H36 and a molecular weight of 348.57 g/mol. Its IUPAC name is 1-[4-ethyl-1-(2-propylphenyl)cyclohexyl]-2-propylbenzene.

Molecular Properties

Compound Name1-[4-ethyl-1-(2-propylphenyl)cyclohexyl]-2-propylbenzene
PubChem CID22420606
Molecular FormulaC26H36
Molecular Weight348.57 g/mol
Exact Mass348.28
IUPAC Name1-[4-ethyl-1-(2-propylphenyl)cyclohexyl]-2-propylbenzene
SMILESCCCc1ccccc1C1(c2ccccc2CCC)CCC(CC)CC1
InChIInChI=1S/C26H36/c1-4-11-22-13-7-9-15-24(22)26(19-17-21(6-3)18-20-26)25-16-10-8-14-23(25)12-5-2/h7-10,13-16,21H,4-6,11-12,17-20H2,1-3H3
InChIKeyFUDLWTYSXOAVBV-UHFFFAOYSA-N
XLogP7.48
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500348.57
LogP ≤ 57.48
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Analyze 1-[4-ethyl-1-(2-propylphenyl)cyclohexyl]-2-propylbenzene 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-[4-ethyl-1-(2-propylphenyl)cyclohexyl]-2-propylbenzene?
The IUPAC name of 1-[4-ethyl-1-(2-propylphenyl)cyclohexyl]-2-propylbenzene (CID 22420606) is 1-[4-ethyl-1-(2-propylphenyl)cyclohexyl]-2-propylbenzene.
What is the SMILES notation for 1-[4-ethyl-1-(2-propylphenyl)cyclohexyl]-2-propylbenzene?
The canonical SMILES for 1-[4-ethyl-1-(2-propylphenyl)cyclohexyl]-2-propylbenzene is CCCc1ccccc1C1(c2ccccc2CCC)CCC(CC)CC1.
What is the InChIKey of 1-[4-ethyl-1-(2-propylphenyl)cyclohexyl]-2-propylbenzene?
The InChIKey is FUDLWTYSXOAVBV-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H36/c1-4-11-22-13-7-9-15-24(22)26(19-17-21(6-3)18-20-26)25-16-10-8-14-23(25)12-5-2/h7-10,13-16,21H,4-6,11-12,17-20H2,1-3H3.
What are the key properties of 1-[4-ethyl-1-(2-propylphenyl)cyclohexyl]-2-propylbenzene?
1-[4-ethyl-1-(2-propylphenyl)cyclohexyl]-2-propylbenzene has a molecular weight of 348.57 g/mol, XLogP of 7.48, 7 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[4-ethyl-1-(2-propylphenyl)cyclohexyl]-2-propylbenzene is sourced from PubChem (CID 22420606), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).