2-methylquinazolin-3-id-4-one;yttrium

C9H7N2OY- — CID 59938499

IUPAC2-methylquinazolin-3-id-4-one;yttrium
SMILESCc1nc2ccccc2c(=O)[n-]1.[Y]
InChIInChI=1S/C9H8N2O.Y/c1-6-10-8-5-3-2-4-7(8)9(12)11-6;/h2-5H,1H3,(H,10,11,12);/p-1
InChIKeyOVAJUXPNILZTOW-UHFFFAOYSA-M
MW248.07 g/mol
LogP0.86
Rot. Bonds

About 2-methylquinazolin-3-id-4-one;yttrium

2-methylquinazolin-3-id-4-one;yttrium (PubChem CID 59938499) has the molecular formula C9H7N2OY- and a molecular weight of 248.07 g/mol. Its IUPAC name is 2-methylquinazolin-3-id-4-one;yttrium.

Molecular Properties

Compound Name2-methylquinazolin-3-id-4-one;yttrium
PubChem CID59938499
Molecular FormulaC9H7N2OY-
Molecular Weight248.07 g/mol
Exact Mass247.96
IUPAC Name2-methylquinazolin-3-id-4-one;yttrium
SMILESCc1nc2ccccc2c(=O)[n-]1.[Y]
InChIInChI=1S/C9H8N2O.Y/c1-6-10-8-5-3-2-4-7(8)9(12)11-6;/h2-5H,1H3,(H,10,11,12);/p-1
InChIKeyOVAJUXPNILZTOW-UHFFFAOYSA-M
XLogP0.86
TPSA44.06 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.07
LogP ≤ 50.86
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2-methylbenzimidazol-1-ide;yttrium
CID 59098019
silver 2-methylbenzimidazol-1-ide
CID 46784053
lithium 2-methylbenzimidazol-1-ide
CID 131740995
4-methylquinoline-2-carbaldehyde
CID 12735795
1,3,5-trimethylbenzo[c][2,6]naphthyridine
CID 118895235
2-(2-methylquinolin-4-yl)acetic acid
CID 79019861
2-methylquinolin-4-amine
CID 162035180
14-(3,5-dimethylphenyl)-8,14-diazatetracyclo[7.6.1.02,7.013,16]hexadeca-1(16),2,4,6,8,10,12-heptaen-15-one
CID 139223995
2-(4-methylphenyl)-3-(4-methyl-2-pyridinyl)quinazolin-4-one
CID 716780
2-methyl-4-methylsulfonylquinoline
CID 4189252
9-[(4-methylphenyl)methyl]acridine;hydrochloride
CID 90679776
2-methyl-4-prop-1-enylquinoline
CID 73094462

Frequently Asked Questions

What is the IUPAC name of 2-methylquinazolin-3-id-4-one;yttrium?
The IUPAC name of 2-methylquinazolin-3-id-4-one;yttrium (CID 59938499) is 2-methylquinazolin-3-id-4-one;yttrium.
What is the SMILES notation for 2-methylquinazolin-3-id-4-one;yttrium?
The canonical SMILES for 2-methylquinazolin-3-id-4-one;yttrium is Cc1nc2ccccc2c(=O)[n-]1.[Y].
What is the InChIKey of 2-methylquinazolin-3-id-4-one;yttrium?
The InChIKey is OVAJUXPNILZTOW-UHFFFAOYSA-M. The full InChI is InChI=1S/C9H8N2O.Y/c1-6-10-8-5-3-2-4-7(8)9(12)11-6;/h2-5H,1H3,(H,10,11,12);/p-1.
What are the key properties of 2-methylquinazolin-3-id-4-one;yttrium?
2-methylquinazolin-3-id-4-one;yttrium has a molecular weight of 248.07 g/mol, XLogP of 0.86, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methylquinazolin-3-id-4-one;yttrium is sourced from PubChem (CID 59938499), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).