(7-azanidylidene-5,8-dimethylquinoxalin-6-ylidene)azanide;yttrium

C10H8N4Y-2 — CID 59017734

IUPAC(7-azanidylidene-5,8-dimethylquinoxalin-6-ylidene)azanide;yttrium
SMILESCC1=c2nccnc2=C(C)C(=[N-])C1=[N-].[Y]
InChIInChI=1S/C10H8N4.Y/c1-5-7(11)8(12)6(2)10-9(5)13-3-4-14-10;/h3-4H,1-2H3;/q-2;
InChIKeyQDWFHBOPAXBIPR-UHFFFAOYSA-N
MW273.11 g/mol
LogP-0.15
Rot. Bonds

About (7-azanidylidene-5,8-dimethylquinoxalin-6-ylidene)azanide;yttrium

(7-azanidylidene-5,8-dimethylquinoxalin-6-ylidene)azanide;yttrium (PubChem CID 59017734) has the molecular formula C10H8N4Y-2 and a molecular weight of 273.11 g/mol. Its IUPAC name is (7-azanidylidene-5,8-dimethylquinoxalin-6-ylidene)azanide;yttrium.

Molecular Properties

Compound Name(7-azanidylidene-5,8-dimethylquinoxalin-6-ylidene)azanide;yttrium
PubChem CID59017734
Molecular FormulaC10H8N4Y-2
Molecular Weight273.11 g/mol
Exact Mass272.98
IUPAC Name(7-azanidylidene-5,8-dimethylquinoxalin-6-ylidene)azanide;yttrium
SMILESCC1=c2nccnc2=C(C)C(=[N-])C1=[N-].[Y]
InChIInChI=1S/C10H8N4.Y/c1-5-7(11)8(12)6(2)10-9(5)13-3-4-14-10;/h3-4H,1-2H3;/q-2;
InChIKeyQDWFHBOPAXBIPR-UHFFFAOYSA-N
XLogP-0.15
TPSA70.38 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.11
LogP ≤ 5-0.15
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_one_A(321)', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}

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Related Compounds

(7-Azanidylidene-5-methylquinoxalin-6-ylidene)azanide;yttrium
CID 57641799
6-N,7-N,5,8-tetramethylquinoxaline-6,7-diimine
CID 59207613
4,9-dimethyl-2H-imidazo[4,5-g]quinoxaline
CID 60012342
5,8-Dimethyl-2,3-dihydroquinoxaline-6,7-diamine
CID 123634298
4,9-Dimethylimidazo[4,5-g]quinoxalin-3-ium
CID 164118880
4,6,7,9-tetramethyl-2H-imidazo[4,5-g]quinoxaline
CID 169800521
5,8-Dimethylquinoxaline-6,7-diimine
CID 59017735

Frequently Asked Questions

What is the IUPAC name of (7-azanidylidene-5,8-dimethylquinoxalin-6-ylidene)azanide;yttrium?
The IUPAC name of (7-azanidylidene-5,8-dimethylquinoxalin-6-ylidene)azanide;yttrium (CID 59017734) is (7-azanidylidene-5,8-dimethylquinoxalin-6-ylidene)azanide;yttrium.
What is the SMILES notation for (7-azanidylidene-5,8-dimethylquinoxalin-6-ylidene)azanide;yttrium?
The canonical SMILES for (7-azanidylidene-5,8-dimethylquinoxalin-6-ylidene)azanide;yttrium is CC1=c2nccnc2=C(C)C(=[N-])C1=[N-].[Y].
What is the InChIKey of (7-azanidylidene-5,8-dimethylquinoxalin-6-ylidene)azanide;yttrium?
The InChIKey is QDWFHBOPAXBIPR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8N4.Y/c1-5-7(11)8(12)6(2)10-9(5)13-3-4-14-10;/h3-4H,1-2H3;/q-2;.
What are the key properties of (7-azanidylidene-5,8-dimethylquinoxalin-6-ylidene)azanide;yttrium?
(7-azanidylidene-5,8-dimethylquinoxalin-6-ylidene)azanide;yttrium has a molecular weight of 273.11 g/mol, XLogP of -0.15, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (7-azanidylidene-5,8-dimethylquinoxalin-6-ylidene)azanide;yttrium is sourced from PubChem (CID 59017734), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).