carbanide;yttrium;azide

CH3N3Y-2 — CID 58755843

IUPACcarbanide;yttrium;azide
SMILES[CH3-].[N-]=[N+]=[N-].[Y]
InChIInChI=1S/CH3.N3.Y/c;1-3-2;/h1H3;;/q2*-1;
InChIKeyZFGSSTLBMRGVRJ-UHFFFAOYSA-N
MW145.96 g/mol
LogP1.31
Rot. Bonds

About carbanide;yttrium;azide

carbanide;yttrium;azide (PubChem CID 58755843) has the molecular formula CH3N3Y-2 and a molecular weight of 145.96 g/mol. Its IUPAC name is carbanide;yttrium;azide.

Molecular Properties

Compound Namecarbanide;yttrium;azide
PubChem CID58755843
Molecular FormulaCH3N3Y-2
Molecular Weight145.96 g/mol
Exact Mass145.94
IUPAC Namecarbanide;yttrium;azide
SMILES[CH3-].[N-]=[N+]=[N-].[Y]
InChIInChI=1S/CH3.N3.Y/c;1-3-2;/h1H3;;/q2*-1;
InChIKeyZFGSSTLBMRGVRJ-UHFFFAOYSA-N
XLogP1.31
TPSA58.70 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms5
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500145.96
LogP ≤ 51.31
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'azo_A(324)', 'substructure': 'N/A'}, {'alert_name': 'Azido_group', 'substructure': 'N/A'}, {'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}, {'alert_name': 'diazo_group', 'substructure': 'N/A'}, {'alert_name': 'quaternary_nitrogen_3', 'substructure': 'N/A'}

Analyze carbanide;yttrium;azide 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 carbanide;yttrium;azide?
The IUPAC name of carbanide;yttrium;azide (CID 58755843) is carbanide;yttrium;azide.
What is the SMILES notation for carbanide;yttrium;azide?
The canonical SMILES for carbanide;yttrium;azide is [CH3-].[N-]=[N+]=[N-].[Y].
What is the InChIKey of carbanide;yttrium;azide?
The InChIKey is ZFGSSTLBMRGVRJ-UHFFFAOYSA-N. The full InChI is InChI=1S/CH3.N3.Y/c;1-3-2;/h1H3;;/q2*-1;.
What are the key properties of carbanide;yttrium;azide?
carbanide;yttrium;azide has a molecular weight of 145.96 g/mol, XLogP of 1.31, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for carbanide;yttrium;azide is sourced from PubChem (CID 58755843), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).