(2E)-2-[(Z)-prop-1-enyl]penta-2,4-dienehydrazide

C8H12N2O — CID 126495583

IUPAC(2E)-2-[(Z)-prop-1-enyl]penta-2,4-dienehydrazide
SMILESC=C/C=C(\C=C/C)C(=O)NN
InChIInChI=1S/C8H12N2O/c1-3-5-7(6-4-2)8(11)10-9/h3-6H,1,9H2,2H3,(H,10,11)/b6-4-,7-5+
InChIKeyNLNQZBXUWHSJBZ-XGXWUAJZSA-N
MW152.20 g/mol
LogP0.66
Rot. Bonds3

About (2E)-2-[(Z)-prop-1-enyl]penta-2,4-dienehydrazide

(2E)-2-[(Z)-prop-1-enyl]penta-2,4-dienehydrazide (PubChem CID 126495583) has the molecular formula C8H12N2O and a molecular weight of 152.20 g/mol. Its IUPAC name is (2E)-2-[(Z)-prop-1-enyl]penta-2,4-dienehydrazide.

Molecular Properties

Compound Name(2E)-2-[(Z)-prop-1-enyl]penta-2,4-dienehydrazide
PubChem CID126495583
Molecular FormulaC8H12N2O
Molecular Weight152.20 g/mol
Exact Mass152.09
IUPAC Name(2E)-2-[(Z)-prop-1-enyl]penta-2,4-dienehydrazide
SMILESC=C/C=C(\C=C/C)C(=O)NN
InChIInChI=1S/C8H12N2O/c1-3-5-7(6-4-2)8(11)10-9/h3-6H,1,9H2,2H3,(H,10,11)/b6-4-,7-5+
InChIKeyNLNQZBXUWHSJBZ-XGXWUAJZSA-N
XLogP0.66
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500152.20
LogP ≤ 50.66
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyl_hydrazine', 'substructure': 'N/A'}, {'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}, {'alert_name': 'polyene', 'substructure': 'N/A'}

Analyze (2E)-2-[(Z)-prop-1-enyl]penta-2,4-dienehydrazide 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)-2-[(Z)-prop-1-enyl]penta-2,4-dienehydrazide?
The IUPAC name of (2E)-2-[(Z)-prop-1-enyl]penta-2,4-dienehydrazide (CID 126495583) is (2E)-2-[(Z)-prop-1-enyl]penta-2,4-dienehydrazide.
What is the SMILES notation for (2E)-2-[(Z)-prop-1-enyl]penta-2,4-dienehydrazide?
The canonical SMILES for (2E)-2-[(Z)-prop-1-enyl]penta-2,4-dienehydrazide is C=C/C=C(\C=C/C)C(=O)NN.
What is the InChIKey of (2E)-2-[(Z)-prop-1-enyl]penta-2,4-dienehydrazide?
The InChIKey is NLNQZBXUWHSJBZ-XGXWUAJZSA-N. The full InChI is InChI=1S/C8H12N2O/c1-3-5-7(6-4-2)8(11)10-9/h3-6H,1,9H2,2H3,(H,10,11)/b6-4-,7-5+.
What are the key properties of (2E)-2-[(Z)-prop-1-enyl]penta-2,4-dienehydrazide?
(2E)-2-[(Z)-prop-1-enyl]penta-2,4-dienehydrazide has a molecular weight of 152.20 g/mol, XLogP of 0.66, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2E)-2-[(Z)-prop-1-enyl]penta-2,4-dienehydrazide is sourced from PubChem (CID 126495583), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).