1-[(Z)-but-2-en-2-yl]-2-ethyl-3-methylcyclopentene

C12H20 — CID 178164613

IUPAC1-[(Z)-but-2-en-2-yl]-2-ethyl-3-methylcyclopentene
SMILESC/C=C(/C)C1=C(CC)C(C)CC1
InChIInChI=1S/C12H20/c1-5-9(3)12-8-7-10(4)11(12)6-2/h5,10H,6-8H2,1-4H3/b9-5-
InChIKeyNXOAYCADODJUKL-UITAMQMPSA-N
MW164.29 g/mol
LogP4.09
Rot. Bonds2

About 1-[(Z)-but-2-en-2-yl]-2-ethyl-3-methylcyclopentene

1-[(Z)-but-2-en-2-yl]-2-ethyl-3-methylcyclopentene (PubChem CID 178164613) has the molecular formula C12H20 and a molecular weight of 164.29 g/mol. Its IUPAC name is 1-[(Z)-but-2-en-2-yl]-2-ethyl-3-methylcyclopentene.

Molecular Properties

Compound Name1-[(Z)-but-2-en-2-yl]-2-ethyl-3-methylcyclopentene
PubChem CID178164613
Molecular FormulaC12H20
Molecular Weight164.29 g/mol
Exact Mass164.16
IUPAC Name1-[(Z)-but-2-en-2-yl]-2-ethyl-3-methylcyclopentene
SMILESC/C=C(/C)C1=C(CC)C(C)CC1
InChIInChI=1S/C12H20/c1-5-9(3)12-8-7-10(4)11(12)6-2/h5,10H,6-8H2,1-4H3/b9-5-
InChIKeyNXOAYCADODJUKL-UITAMQMPSA-N
XLogP4.09
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500164.29
LogP ≤ 54.09
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Analyze 1-[(Z)-but-2-en-2-yl]-2-ethyl-3-methylcyclopentene 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-[(Z)-but-2-en-2-yl]-2-ethyl-3-methylcyclopentene?
The IUPAC name of 1-[(Z)-but-2-en-2-yl]-2-ethyl-3-methylcyclopentene (CID 178164613) is 1-[(Z)-but-2-en-2-yl]-2-ethyl-3-methylcyclopentene.
What is the SMILES notation for 1-[(Z)-but-2-en-2-yl]-2-ethyl-3-methylcyclopentene?
The canonical SMILES for 1-[(Z)-but-2-en-2-yl]-2-ethyl-3-methylcyclopentene is C/C=C(/C)C1=C(CC)C(C)CC1.
What is the InChIKey of 1-[(Z)-but-2-en-2-yl]-2-ethyl-3-methylcyclopentene?
The InChIKey is NXOAYCADODJUKL-UITAMQMPSA-N. The full InChI is InChI=1S/C12H20/c1-5-9(3)12-8-7-10(4)11(12)6-2/h5,10H,6-8H2,1-4H3/b9-5-.
What are the key properties of 1-[(Z)-but-2-en-2-yl]-2-ethyl-3-methylcyclopentene?
1-[(Z)-but-2-en-2-yl]-2-ethyl-3-methylcyclopentene has a molecular weight of 164.29 g/mol, XLogP of 4.09, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(Z)-but-2-en-2-yl]-2-ethyl-3-methylcyclopentene is sourced from PubChem (CID 178164613), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).