oxido-(2-undeca-2,4,7-trienylidenehydrazinyl)azanium

C11H19N3O — CID 139031922

IUPACoxido-(2-undeca-2,4,7-trienylidenehydrazinyl)azanium
SMILESCCCC=CCC=CC=CC=NN[NH2+][O-]
InChIInChI=1S/C11H19N3O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15/h4-5,7-11,13H,2-3,6,14H2,1H3
InChIKeyDQMOSRDZWQSBHC-UHFFFAOYSA-N
MW209.29 g/mol
LogP1.40
Rot. Bonds8

About oxido-(2-undeca-2,4,7-trienylidenehydrazinyl)azanium

oxido-(2-undeca-2,4,7-trienylidenehydrazinyl)azanium (PubChem CID 139031922) has the molecular formula C11H19N3O and a molecular weight of 209.29 g/mol. Its IUPAC name is oxido-(2-undeca-2,4,7-trienylidenehydrazinyl)azanium.

Molecular Properties

Compound Nameoxido-(2-undeca-2,4,7-trienylidenehydrazinyl)azanium
PubChem CID139031922
Molecular FormulaC11H19N3O
Molecular Weight209.29 g/mol
Exact Mass209.15
IUPAC Nameoxido-(2-undeca-2,4,7-trienylidenehydrazinyl)azanium
SMILESCCCC=CCC=CC=CC=NN[NH2+][O-]
InChIInChI=1S/C11H19N3O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15/h4-5,7-11,13H,2-3,6,14H2,1H3
InChIKeyDQMOSRDZWQSBHC-UHFFFAOYSA-N
XLogP1.40
TPSA64.06 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.29
LogP ≤ 51.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}, {'alert_name': 'polyene', 'substructure': 'N/A'}

Analyze oxido-(2-undeca-2,4,7-trienylidenehydrazinyl)azanium 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 oxido-(2-undeca-2,4,7-trienylidenehydrazinyl)azanium?
The IUPAC name of oxido-(2-undeca-2,4,7-trienylidenehydrazinyl)azanium (CID 139031922) is oxido-(2-undeca-2,4,7-trienylidenehydrazinyl)azanium.
What is the SMILES notation for oxido-(2-undeca-2,4,7-trienylidenehydrazinyl)azanium?
The canonical SMILES for oxido-(2-undeca-2,4,7-trienylidenehydrazinyl)azanium is CCCC=CCC=CC=CC=NN[NH2+][O-].
What is the InChIKey of oxido-(2-undeca-2,4,7-trienylidenehydrazinyl)azanium?
The InChIKey is DQMOSRDZWQSBHC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15/h4-5,7-11,13H,2-3,6,14H2,1H3.
What are the key properties of oxido-(2-undeca-2,4,7-trienylidenehydrazinyl)azanium?
oxido-(2-undeca-2,4,7-trienylidenehydrazinyl)azanium has a molecular weight of 209.29 g/mol, XLogP of 1.40, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for oxido-(2-undeca-2,4,7-trienylidenehydrazinyl)azanium is sourced from PubChem (CID 139031922), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).