(2E,4Z)-1-(prop-2-enylideneamino)hexa-2,4-dien-2-amine

C9H14N2 — CID 88547835

IUPAC(2E,4Z)-1-(prop-2-enylideneamino)hexa-2,4-dien-2-amine
SMILESC=C/C=N/C/C(N)=C\C=C/C
InChIInChI=1S/C9H14N2/c1-3-5-6-9(10)8-11-7-4-2/h3-7H,2,8,10H2,1H3/b5-3-,9-6+,11-7+
InChIKeyJZZAMXCNIGUJRN-UNPLBVGJSA-N
MW150.22 g/mol
LogP1.66
Rot. Bonds4

About (2E,4Z)-1-(prop-2-enylideneamino)hexa-2,4-dien-2-amine

(2E,4Z)-1-(prop-2-enylideneamino)hexa-2,4-dien-2-amine (PubChem CID 88547835) has the molecular formula C9H14N2 and a molecular weight of 150.22 g/mol. Its IUPAC name is (2E,4Z)-1-(prop-2-enylideneamino)hexa-2,4-dien-2-amine.

Molecular Properties

Compound Name(2E,4Z)-1-(prop-2-enylideneamino)hexa-2,4-dien-2-amine
PubChem CID88547835
Molecular FormulaC9H14N2
Molecular Weight150.22 g/mol
Exact Mass150.12
IUPAC Name(2E,4Z)-1-(prop-2-enylideneamino)hexa-2,4-dien-2-amine
SMILESC=C/C=N/C/C(N)=C\C=C/C
InChIInChI=1S/C9H14N2/c1-3-5-6-9(10)8-11-7-4-2/h3-7H,2,8,10H2,1H3/b5-3-,9-6+,11-7+
InChIKeyJZZAMXCNIGUJRN-UNPLBVGJSA-N
XLogP1.66
TPSA38.38 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500150.22
LogP ≤ 51.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze (2E,4Z)-1-(prop-2-enylideneamino)hexa-2,4-dien-2-amine 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 (2E,4Z)-1-(prop-2-enylideneamino)hexa-2,4-dien-2-amine?
The IUPAC name of (2E,4Z)-1-(prop-2-enylideneamino)hexa-2,4-dien-2-amine (CID 88547835) is (2E,4Z)-1-(prop-2-enylideneamino)hexa-2,4-dien-2-amine.
What is the SMILES notation for (2E,4Z)-1-(prop-2-enylideneamino)hexa-2,4-dien-2-amine?
The canonical SMILES for (2E,4Z)-1-(prop-2-enylideneamino)hexa-2,4-dien-2-amine is C=C/C=N/C/C(N)=C\C=C/C.
What is the InChIKey of (2E,4Z)-1-(prop-2-enylideneamino)hexa-2,4-dien-2-amine?
The InChIKey is JZZAMXCNIGUJRN-UNPLBVGJSA-N. The full InChI is InChI=1S/C9H14N2/c1-3-5-6-9(10)8-11-7-4-2/h3-7H,2,8,10H2,1H3/b5-3-,9-6+,11-7+.
What are the key properties of (2E,4Z)-1-(prop-2-enylideneamino)hexa-2,4-dien-2-amine?
(2E,4Z)-1-(prop-2-enylideneamino)hexa-2,4-dien-2-amine has a molecular weight of 150.22 g/mol, XLogP of 1.66, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2E,4Z)-1-(prop-2-enylideneamino)hexa-2,4-dien-2-amine is sourced from PubChem (CID 88547835), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).