N'-hexa-2,4-dienylhexa-2,4-dienehydrazide

C12H18N2O — CID 54306548

IUPACN'-hexa-2,4-dienylhexa-2,4-dienehydrazide
SMILESCC=CC=CCNNC(=O)C=CC=CC
InChIInChI=1S/C12H18N2O/c1-3-5-7-9-11-13-14-12(15)10-8-6-4-2/h3-10,13H,11H2,1-2H3,(H,14,15)
InChIKeyDOTFTPHSKYFMFQ-UHFFFAOYSA-N
MW206.29 g/mol
LogP1.87
Rot. Bonds6

About N'-hexa-2,4-dienylhexa-2,4-dienehydrazide

N'-hexa-2,4-dienylhexa-2,4-dienehydrazide (PubChem CID 54306548) has the molecular formula C12H18N2O and a molecular weight of 206.29 g/mol. Its IUPAC name is N'-hexa-2,4-dienylhexa-2,4-dienehydrazide.

Molecular Properties

Compound NameN'-hexa-2,4-dienylhexa-2,4-dienehydrazide
PubChem CID54306548
Molecular FormulaC12H18N2O
Molecular Weight206.29 g/mol
Exact Mass206.14
IUPAC NameN'-hexa-2,4-dienylhexa-2,4-dienehydrazide
SMILESCC=CC=CCNNC(=O)C=CC=CC
InChIInChI=1S/C12H18N2O/c1-3-5-7-9-11-13-14-12(15)10-8-6-4-2/h3-10,13H,11H2,1-2H3,(H,14,15)
InChIKeyDOTFTPHSKYFMFQ-UHFFFAOYSA-N
XLogP1.87
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.29
LogP ≤ 51.87
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', '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 N'-hexa-2,4-dienylhexa-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 N'-hexa-2,4-dienylhexa-2,4-dienehydrazide?
The IUPAC name of N'-hexa-2,4-dienylhexa-2,4-dienehydrazide (CID 54306548) is N'-hexa-2,4-dienylhexa-2,4-dienehydrazide.
What is the SMILES notation for N'-hexa-2,4-dienylhexa-2,4-dienehydrazide?
The canonical SMILES for N'-hexa-2,4-dienylhexa-2,4-dienehydrazide is CC=CC=CCNNC(=O)C=CC=CC.
What is the InChIKey of N'-hexa-2,4-dienylhexa-2,4-dienehydrazide?
The InChIKey is DOTFTPHSKYFMFQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N2O/c1-3-5-7-9-11-13-14-12(15)10-8-6-4-2/h3-10,13H,11H2,1-2H3,(H,14,15).
What are the key properties of N'-hexa-2,4-dienylhexa-2,4-dienehydrazide?
N'-hexa-2,4-dienylhexa-2,4-dienehydrazide has a molecular weight of 206.29 g/mol, XLogP of 1.87, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N'-hexa-2,4-dienylhexa-2,4-dienehydrazide is sourced from PubChem (CID 54306548), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).