2-ethylcyclopent-2-en-1-imine

C7H11N — CID 149143293

IUPAC2-ethylcyclopent-2-en-1-imine
SMILES[H]/N=C1\CCC=C1CC
InChIInChI=1S/C7H11N/c1-2-6-4-3-5-7(6)8/h4,8H,2-3,5H2,1H3/b8-7+
InChIKeyRIXMDUYNLBOTFT-BQYQJAHWSA-N
MW109.17 g/mol
LogP2.14
Rot. Bonds1

About 2-ethylcyclopent-2-en-1-imine

2-ethylcyclopent-2-en-1-imine (PubChem CID 149143293) has the molecular formula C7H11N and a molecular weight of 109.17 g/mol. Its IUPAC name is 2-ethylcyclopent-2-en-1-imine.

Molecular Properties

Compound Name2-ethylcyclopent-2-en-1-imine
PubChem CID149143293
Molecular FormulaC7H11N
Molecular Weight109.17 g/mol
Exact Mass109.09
IUPAC Name2-ethylcyclopent-2-en-1-imine
SMILES[H]/N=C1\CCC=C1CC
InChIInChI=1S/C7H11N/c1-2-6-4-3-5-7(6)8/h4,8H,2-3,5H2,1H3/b8-7+
InChIKeyRIXMDUYNLBOTFT-BQYQJAHWSA-N
XLogP2.14
TPSA23.85 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500109.17
LogP ≤ 52.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}

Analyze 2-ethylcyclopent-2-en-1-imine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

6,10,15,19,23-Pentamethyltetracosa-6,10,14,18,22-pentaen-2-imine
CID 53649182
3-Methyl-2-cyclopentenimine
CID 91232431
N-[(1E)-1-(Cyclopent-1-en-1-yl)ethylidene]hydroxylamine
CID 5963026
2-[(3-Methylcyclopent-2-en-1-ylidene)amino]guanidine
CID 4409748
1-Cyclopenta-1,3-dien-1-ylethanimine
CID 12554024
2-Ethylidenecyclohexan-1-imine
CID 14026307
3-Methylpent-3-en-2-imine
CID 15835473
2-Butyl-3,5-dimethylcyclohexa-2,5-diene-1,4-diimine
CID 18620279
(2E)-2-ethylidenecyclohexan-1-imine
CID 20159053
6-Methyl-3-propan-2-ylidenehept-5-en-2-imine
CID 21319963
(2E)-2-propylidenecyclohexan-1-imine
CID 21514603
Cyclohept-2-en-1-imine
CID 22213566

Frequently Asked Questions

What is the IUPAC name of 2-ethylcyclopent-2-en-1-imine?
The IUPAC name of 2-ethylcyclopent-2-en-1-imine (CID 149143293) is 2-ethylcyclopent-2-en-1-imine.
What is the SMILES notation for 2-ethylcyclopent-2-en-1-imine?
The canonical SMILES for 2-ethylcyclopent-2-en-1-imine is [H]/N=C1\CCC=C1CC.
What is the InChIKey of 2-ethylcyclopent-2-en-1-imine?
The InChIKey is RIXMDUYNLBOTFT-BQYQJAHWSA-N. The full InChI is InChI=1S/C7H11N/c1-2-6-4-3-5-7(6)8/h4,8H,2-3,5H2,1H3/b8-7+.
What are the key properties of 2-ethylcyclopent-2-en-1-imine?
2-ethylcyclopent-2-en-1-imine has a molecular weight of 109.17 g/mol, XLogP of 2.14, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethylcyclopent-2-en-1-imine is sourced from PubChem (CID 149143293), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).