(2Z)-2-ethylidenepent-4-en-1-imine

C7H11N — CID 171644246

IUPAC(2Z)-2-ethylidenepent-4-en-1-imine
SMILES[H]/N=C/C(=C\C)CC=C
InChIInChI=1S/C7H11N/c1-3-5-7(4-2)6-8/h3-4,6,8H,1,5H2,2H3/b7-4-,8-6+
InChIKeyJDIUKWWNPNYIBM-ZJLRGQKUSA-N
MW109.17 g/mol
LogP2.16
Rot. Bonds3

About (2Z)-2-ethylidenepent-4-en-1-imine

(2Z)-2-ethylidenepent-4-en-1-imine (PubChem CID 171644246) has the molecular formula C7H11N and a molecular weight of 109.17 g/mol. Its IUPAC name is (2Z)-2-ethylidenepent-4-en-1-imine.

Molecular Properties

Compound Name(2Z)-2-ethylidenepent-4-en-1-imine
PubChem CID171644246
Molecular FormulaC7H11N
Molecular Weight109.17 g/mol
Exact Mass109.09
IUPAC Name(2Z)-2-ethylidenepent-4-en-1-imine
SMILES[H]/N=C/C(=C\C)CC=C
InChIInChI=1S/C7H11N/c1-3-5-7(4-2)6-8/h3-4,6,8H,1,5H2,2H3/b7-4-,8-6+
InChIKeyJDIUKWWNPNYIBM-ZJLRGQKUSA-N
XLogP2.16
TPSA23.85 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500109.17
LogP ≤ 52.16
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'}

Analyze (2Z)-2-ethylidenepent-4-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

4-ethenylhexa-1,4-diene
CID 85441048
(2Z)-3-methanimidoyl-2-prop-2-enylhexa-2,5-dienal
CID 173086804
(2E)-2-ethylidene-N-methylpent-4-en-1-imine
CID 144940239
(5Z)-2-methylidene-6-propylnona-5,8-dien-1-imine
CID 167108317
4-ethylideneundeca-1,5,7,9-tetraene
CID 151010728
(Z,5Z)-9-methyl-2-methylidene-3-prop-2-enyl-5-prop-2-enylidenedec-3-en-1-imine
CID 146288585
(2E)-2-ethylidene-N-[(Z)-prop-1-enyl]pent-4-en-1-imine
CID 143654384
[5-[(2E)-hexa-2,5-dien-3-yl]furan-2-yl]methanimine
CID 163831309
ethane;(2Z)-2-[2-(3-fluorodibenzofuran-4-yl)ethylidene]pent-4-en-1-imine
CID 145272727
(2E,3Z)-2-ethylidenehexa-3,5-dien-1-imine
CID 143548384
(2Z)-2-ethylidenepent-4-ene-1,3-diimine
CID 123930405
ethane;(4E)-4-ethenylhepta-1,4-diene;prop-1-ene
CID 143290103

Frequently Asked Questions

What is the IUPAC name of (2Z)-2-ethylidenepent-4-en-1-imine?
The IUPAC name of (2Z)-2-ethylidenepent-4-en-1-imine (CID 171644246) is (2Z)-2-ethylidenepent-4-en-1-imine.
What is the SMILES notation for (2Z)-2-ethylidenepent-4-en-1-imine?
The canonical SMILES for (2Z)-2-ethylidenepent-4-en-1-imine is [H]/N=C/C(=C\C)CC=C.
What is the InChIKey of (2Z)-2-ethylidenepent-4-en-1-imine?
The InChIKey is JDIUKWWNPNYIBM-ZJLRGQKUSA-N. The full InChI is InChI=1S/C7H11N/c1-3-5-7(4-2)6-8/h3-4,6,8H,1,5H2,2H3/b7-4-,8-6+.
What are the key properties of (2Z)-2-ethylidenepent-4-en-1-imine?
(2Z)-2-ethylidenepent-4-en-1-imine has a molecular weight of 109.17 g/mol, XLogP of 2.16, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2Z)-2-ethylidenepent-4-en-1-imine is sourced from PubChem (CID 171644246), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).