2-ethenylcyclopentan-1-imine

C7H11N — CID 163704497

IUPAC2-ethenylcyclopentan-1-imine
SMILES[H]/N=C1\CCCC1C=C
InChIInChI=1S/C7H11N/c1-2-6-4-3-5-7(6)8/h2,6,8H,1,3-5H2/b8-7+
InChIKeyKDWMIKSUVKNQLT-BQYQJAHWSA-N
MW109.17 g/mol
LogP1.99
Rot. Bonds1

About 2-ethenylcyclopentan-1-imine

2-ethenylcyclopentan-1-imine (PubChem CID 163704497) has the molecular formula C7H11N and a molecular weight of 109.17 g/mol. Its IUPAC name is 2-ethenylcyclopentan-1-imine.

Molecular Properties

Compound Name2-ethenylcyclopentan-1-imine
PubChem CID163704497
Molecular FormulaC7H11N
Molecular Weight109.17 g/mol
Exact Mass109.09
IUPAC Name2-ethenylcyclopentan-1-imine
SMILES[H]/N=C1\CCCC1C=C
InChIInChI=1S/C7H11N/c1-2-6-4-3-5-7(6)8/h2,6,8H,1,3-5H2/b8-7+
InChIKeyKDWMIKSUVKNQLT-BQYQJAHWSA-N
XLogP1.99
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 ≤ 51.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

(1S,4S)-bicyclo[2.2.1]hept-5-en-2-imine
CID 134893192
Bicyclo[2.2.1]hept-5-en-2-imine
CID 14118226
4-Methylhept-6-en-3-imine
CID 123204332
4-Methylhept-6-en-2-imine
CID 123395995
4-Methylhex-5-en-2-imine
CID 124028370
3-Propylhex-5-en-2-imine
CID 142132618
(2R)-2-ethenylcyclopentan-1-imine
CID 144786080
2-Ethyl-3-methylidenecyclopentan-1-imine
CID 163960541
6-Ethenylocta-1,7-dien-3-imine
CID 163963706
1-(2-Ethenylcyclopropyl)ethanimine
CID 142996662
1-(3-Methylidenecyclopentyl)ethanimine
CID 168179389

Frequently Asked Questions

What is the IUPAC name of 2-ethenylcyclopentan-1-imine?
The IUPAC name of 2-ethenylcyclopentan-1-imine (CID 163704497) is 2-ethenylcyclopentan-1-imine.
What is the SMILES notation for 2-ethenylcyclopentan-1-imine?
The canonical SMILES for 2-ethenylcyclopentan-1-imine is [H]/N=C1\CCCC1C=C.
What is the InChIKey of 2-ethenylcyclopentan-1-imine?
The InChIKey is KDWMIKSUVKNQLT-BQYQJAHWSA-N. The full InChI is InChI=1S/C7H11N/c1-2-6-4-3-5-7(6)8/h2,6,8H,1,3-5H2/b8-7+.
What are the key properties of 2-ethenylcyclopentan-1-imine?
2-ethenylcyclopentan-1-imine has a molecular weight of 109.17 g/mol, XLogP of 1.99, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethenylcyclopentan-1-imine is sourced from PubChem (CID 163704497), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).