1-ethyl-2-[2-(2-ethylcyclohexyl)propan-2-yl]cyclohexane

C19H36 — CID 154060366

IUPAC1-ethyl-2-[2-(2-ethylcyclohexyl)propan-2-yl]cyclohexane
SMILESCCC1CCCCC1C(C)(C)C1CCCCC1CC
InChIInChI=1S/C19H36/c1-5-15-11-7-9-13-17(15)19(3,4)18-14-10-8-12-16(18)6-2/h15-18H,5-14H2,1-4H3
InChIKeyIDQAJFZLEXLQOX-UHFFFAOYSA-N
MW264.50 g/mol
LogP6.45
Rot. Bonds4

About 1-ethyl-2-[2-(2-ethylcyclohexyl)propan-2-yl]cyclohexane

1-ethyl-2-[2-(2-ethylcyclohexyl)propan-2-yl]cyclohexane (PubChem CID 154060366) has the molecular formula C19H36 and a molecular weight of 264.50 g/mol. Its IUPAC name is 1-ethyl-2-[2-(2-ethylcyclohexyl)propan-2-yl]cyclohexane.

Molecular Properties

Compound Name1-ethyl-2-[2-(2-ethylcyclohexyl)propan-2-yl]cyclohexane
PubChem CID154060366
Molecular FormulaC19H36
Molecular Weight264.50 g/mol
Exact Mass264.28
IUPAC Name1-ethyl-2-[2-(2-ethylcyclohexyl)propan-2-yl]cyclohexane
SMILESCCC1CCCCC1C(C)(C)C1CCCCC1CC
InChIInChI=1S/C19H36/c1-5-15-11-7-9-13-17(15)19(3,4)18-14-10-8-12-16(18)6-2/h15-18H,5-14H2,1-4H3
InChIKeyIDQAJFZLEXLQOX-UHFFFAOYSA-N
XLogP6.45
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500264.50
LogP ≤ 56.45
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Analyze 1-ethyl-2-[2-(2-ethylcyclohexyl)propan-2-yl]cyclohexane 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-2-[2-(2-ethylcyclohexyl)propan-2-yl]cyclohexane?
The IUPAC name of 1-ethyl-2-[2-(2-ethylcyclohexyl)propan-2-yl]cyclohexane (CID 154060366) is 1-ethyl-2-[2-(2-ethylcyclohexyl)propan-2-yl]cyclohexane.
What is the SMILES notation for 1-ethyl-2-[2-(2-ethylcyclohexyl)propan-2-yl]cyclohexane?
The canonical SMILES for 1-ethyl-2-[2-(2-ethylcyclohexyl)propan-2-yl]cyclohexane is CCC1CCCCC1C(C)(C)C1CCCCC1CC.
What is the InChIKey of 1-ethyl-2-[2-(2-ethylcyclohexyl)propan-2-yl]cyclohexane?
The InChIKey is IDQAJFZLEXLQOX-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H36/c1-5-15-11-7-9-13-17(15)19(3,4)18-14-10-8-12-16(18)6-2/h15-18H,5-14H2,1-4H3.
What are the key properties of 1-ethyl-2-[2-(2-ethylcyclohexyl)propan-2-yl]cyclohexane?
1-ethyl-2-[2-(2-ethylcyclohexyl)propan-2-yl]cyclohexane has a molecular weight of 264.50 g/mol, XLogP of 6.45, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-2-[2-(2-ethylcyclohexyl)propan-2-yl]cyclohexane is sourced from PubChem (CID 154060366), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).