4-ethyl-1-(2-methylbut-2-enyl)-2-propylcyclopentane

C15H28 — CID 123240051

IUPAC4-ethyl-1-(2-methylbut-2-enyl)-2-propylcyclopentane
SMILESCC=C(C)CC1CC(CC)CC1CCC
InChIInChI=1S/C15H28/c1-5-8-14-10-13(7-3)11-15(14)9-12(4)6-2/h6,13-15H,5,7-11H2,1-4H3
InChIKeyDZAYMDFVJDOJGS-UHFFFAOYSA-N
MW208.39 g/mol
LogP5.20
Rot. Bonds5

About 4-ethyl-1-(2-methylbut-2-enyl)-2-propylcyclopentane

4-ethyl-1-(2-methylbut-2-enyl)-2-propylcyclopentane (PubChem CID 123240051) has the molecular formula C15H28 and a molecular weight of 208.39 g/mol. Its IUPAC name is 4-ethyl-1-(2-methylbut-2-enyl)-2-propylcyclopentane.

Molecular Properties

Compound Name4-ethyl-1-(2-methylbut-2-enyl)-2-propylcyclopentane
PubChem CID123240051
Molecular FormulaC15H28
Molecular Weight208.39 g/mol
Exact Mass208.22
IUPAC Name4-ethyl-1-(2-methylbut-2-enyl)-2-propylcyclopentane
SMILESCC=C(C)CC1CC(CC)CC1CCC
InChIInChI=1S/C15H28/c1-5-8-14-10-13(7-3)11-15(14)9-12(4)6-2/h6,13-15H,5,7-11H2,1-4H3
InChIKeyDZAYMDFVJDOJGS-UHFFFAOYSA-N
XLogP5.20
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500208.39
LogP ≤ 55.20
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

Analyze 4-ethyl-1-(2-methylbut-2-enyl)-2-propylcyclopentane 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 4-ethyl-1-(2-methylbut-2-enyl)-2-propylcyclopentane?
The IUPAC name of 4-ethyl-1-(2-methylbut-2-enyl)-2-propylcyclopentane (CID 123240051) is 4-ethyl-1-(2-methylbut-2-enyl)-2-propylcyclopentane.
What is the SMILES notation for 4-ethyl-1-(2-methylbut-2-enyl)-2-propylcyclopentane?
The canonical SMILES for 4-ethyl-1-(2-methylbut-2-enyl)-2-propylcyclopentane is CC=C(C)CC1CC(CC)CC1CCC.
What is the InChIKey of 4-ethyl-1-(2-methylbut-2-enyl)-2-propylcyclopentane?
The InChIKey is DZAYMDFVJDOJGS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28/c1-5-8-14-10-13(7-3)11-15(14)9-12(4)6-2/h6,13-15H,5,7-11H2,1-4H3.
What are the key properties of 4-ethyl-1-(2-methylbut-2-enyl)-2-propylcyclopentane?
4-ethyl-1-(2-methylbut-2-enyl)-2-propylcyclopentane has a molecular weight of 208.39 g/mol, XLogP of 5.20, 5 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-1-(2-methylbut-2-enyl)-2-propylcyclopentane is sourced from PubChem (CID 123240051), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).