4-ethyl-N-[(Z)-prop-1-enyl]non-1-en-3-imine

C14H25N — CID 134276533

IUPAC4-ethyl-N-[(Z)-prop-1-enyl]non-1-en-3-imine
SMILESC=C/C(=N\C=C/C)C(CC)CCCCC
InChIInChI=1S/C14H25N/c1-5-9-10-11-13(7-3)14(8-4)15-12-6-2/h6,8,12-13H,4-5,7,9-11H2,1-3H3/b12-6-,15-14+
InChIKeyIACXQUNDEHJRQA-PAPCULQVSA-N
MW207.36 g/mol
LogP4.75
Rot. Bonds8

About 4-ethyl-N-[(Z)-prop-1-enyl]non-1-en-3-imine

4-ethyl-N-[(Z)-prop-1-enyl]non-1-en-3-imine (PubChem CID 134276533) has the molecular formula C14H25N and a molecular weight of 207.36 g/mol. Its IUPAC name is 4-ethyl-N-[(Z)-prop-1-enyl]non-1-en-3-imine.

Molecular Properties

Compound Name4-ethyl-N-[(Z)-prop-1-enyl]non-1-en-3-imine
PubChem CID134276533
Molecular FormulaC14H25N
Molecular Weight207.36 g/mol
Exact Mass207.20
IUPAC Name4-ethyl-N-[(Z)-prop-1-enyl]non-1-en-3-imine
SMILESC=C/C(=N\C=C/C)C(CC)CCCCC
InChIInChI=1S/C14H25N/c1-5-9-10-11-13(7-3)14(8-4)15-12-6-2/h6,8,12-13H,4-5,7,9-11H2,1-3H3/b12-6-,15-14+
InChIKeyIACXQUNDEHJRQA-PAPCULQVSA-N
XLogP4.75
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds8
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.36
LogP ≤ 54.75
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze 4-ethyl-N-[(Z)-prop-1-enyl]non-1-en-3-imine 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-N-[(Z)-prop-1-enyl]non-1-en-3-imine?
The IUPAC name of 4-ethyl-N-[(Z)-prop-1-enyl]non-1-en-3-imine (CID 134276533) is 4-ethyl-N-[(Z)-prop-1-enyl]non-1-en-3-imine.
What is the SMILES notation for 4-ethyl-N-[(Z)-prop-1-enyl]non-1-en-3-imine?
The canonical SMILES for 4-ethyl-N-[(Z)-prop-1-enyl]non-1-en-3-imine is C=C/C(=N\C=C/C)C(CC)CCCCC.
What is the InChIKey of 4-ethyl-N-[(Z)-prop-1-enyl]non-1-en-3-imine?
The InChIKey is IACXQUNDEHJRQA-PAPCULQVSA-N. The full InChI is InChI=1S/C14H25N/c1-5-9-10-11-13(7-3)14(8-4)15-12-6-2/h6,8,12-13H,4-5,7,9-11H2,1-3H3/b12-6-,15-14+.
What are the key properties of 4-ethyl-N-[(Z)-prop-1-enyl]non-1-en-3-imine?
4-ethyl-N-[(Z)-prop-1-enyl]non-1-en-3-imine has a molecular weight of 207.36 g/mol, XLogP of 4.75, 8 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-N-[(Z)-prop-1-enyl]non-1-en-3-imine is sourced from PubChem (CID 134276533), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).