(6-azanidylidenecyclohexa-2,4-dien-1-ylidene)azanide;chlorozinc(1+);yttrium

C6H3ClN2YZn-2 — CID 134965446

IUPAC(6-azanidylidenecyclohexa-2,4-dien-1-ylidene)azanide;chlorozinc(1+);yttrium
SMILESCl[Zn+].[N-]=C1[C-]=CC=CC1=[N-].[Y]
InChIInChI=1S/C6H3N2.ClH.Y.Zn/c7-5-3-1-2-4-6(5)8;;;/h1-3H;1H;;/q-3;;;+2/p-1
InChIKeyCNZZLKHJPBZVHE-UHFFFAOYSA-M
MW292.85 g/mol
LogP1.62
Rot. Bonds

About (6-azanidylidenecyclohexa-2,4-dien-1-ylidene)azanide;chlorozinc(1+);yttrium

(6-azanidylidenecyclohexa-2,4-dien-1-ylidene)azanide;chlorozinc(1+);yttrium (PubChem CID 134965446) has the molecular formula C6H3ClN2YZn-2 and a molecular weight of 292.85 g/mol. Its IUPAC name is (6-azanidylidenecyclohexa-2,4-dien-1-ylidene)azanide;chlorozinc(1+);yttrium.

Molecular Properties

Compound Name(6-azanidylidenecyclohexa-2,4-dien-1-ylidene)azanide;chlorozinc(1+);yttrium
PubChem CID134965446
Molecular FormulaC6H3ClN2YZn-2
Molecular Weight292.85 g/mol
Exact Mass290.83
IUPAC Name(6-azanidylidenecyclohexa-2,4-dien-1-ylidene)azanide;chlorozinc(1+);yttrium
SMILESCl[Zn+].[N-]=C1[C-]=CC=CC1=[N-].[Y]
InChIInChI=1S/C6H3N2.ClH.Y.Zn/c7-5-3-1-2-4-6(5)8;;;/h1-3H;1H;;/q-3;;;+2/p-1
InChIKeyCNZZLKHJPBZVHE-UHFFFAOYSA-M
XLogP1.62
TPSA44.60 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.85
LogP ≤ 51.62
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_one_A(321)', 'substructure': 'N/A'}, {'alert_name': 'quinone_D(2)', 'substructure': 'N/A'}, {'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}, {'alert_name': 'chinone_2', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}

Analyze (6-azanidylidenecyclohexa-2,4-dien-1-ylidene)azanide;chlorozinc(1+);yttrium 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 (6-azanidylidenecyclohexa-2,4-dien-1-ylidene)azanide;chlorozinc(1+);yttrium?
The IUPAC name of (6-azanidylidenecyclohexa-2,4-dien-1-ylidene)azanide;chlorozinc(1+);yttrium (CID 134965446) is (6-azanidylidenecyclohexa-2,4-dien-1-ylidene)azanide;chlorozinc(1+);yttrium.
What is the SMILES notation for (6-azanidylidenecyclohexa-2,4-dien-1-ylidene)azanide;chlorozinc(1+);yttrium?
The canonical SMILES for (6-azanidylidenecyclohexa-2,4-dien-1-ylidene)azanide;chlorozinc(1+);yttrium is Cl[Zn+].[N-]=C1[C-]=CC=CC1=[N-].[Y].
What is the InChIKey of (6-azanidylidenecyclohexa-2,4-dien-1-ylidene)azanide;chlorozinc(1+);yttrium?
The InChIKey is CNZZLKHJPBZVHE-UHFFFAOYSA-M. The full InChI is InChI=1S/C6H3N2.ClH.Y.Zn/c7-5-3-1-2-4-6(5)8;;;/h1-3H;1H;;/q-3;;;+2/p-1.
What are the key properties of (6-azanidylidenecyclohexa-2,4-dien-1-ylidene)azanide;chlorozinc(1+);yttrium?
(6-azanidylidenecyclohexa-2,4-dien-1-ylidene)azanide;chlorozinc(1+);yttrium has a molecular weight of 292.85 g/mol, XLogP of 1.62, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (6-azanidylidenecyclohexa-2,4-dien-1-ylidene)azanide;chlorozinc(1+);yttrium is sourced from PubChem (CID 134965446), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).