7-methoxy-6-methyl-3H-quinazolin-4-one

C10H10N2O2 — CID 135980182

IUPAC7-methoxy-6-methyl-3H-quinazolin-4-one
SMILESCOc1cc2nc[nH]c(=O)c2cc1C
InChIInChI=1S/C10H10N2O2/c1-6-3-7-8(4-9(6)14-2)11-5-12-10(7)13/h3-5H,1-2H3,(H,11,12,13)
InChIKeyLEOCYDAZDIEWMV-UHFFFAOYSA-N
MW190.20 g/mol
LogP1.24
Rot. Bonds1

About 7-methoxy-6-methyl-3H-quinazolin-4-one

7-methoxy-6-methyl-3H-quinazolin-4-one (PubChem CID 135980182) has the molecular formula C10H10N2O2 and a molecular weight of 190.20 g/mol. Its IUPAC name is 7-methoxy-6-methyl-3H-quinazolin-4-one.

Molecular Properties

Compound Name7-methoxy-6-methyl-3H-quinazolin-4-one
PubChem CID135980182
Molecular FormulaC10H10N2O2
Molecular Weight190.20 g/mol
Exact Mass190.07
IUPAC Name7-methoxy-6-methyl-3H-quinazolin-4-one
SMILESCOc1cc2nc[nH]c(=O)c2cc1C
InChIInChI=1S/C10H10N2O2/c1-6-3-7-8(4-9(6)14-2)11-5-12-10(7)13/h3-5H,1-2H3,(H,11,12,13)
InChIKeyLEOCYDAZDIEWMV-UHFFFAOYSA-N
XLogP1.24
TPSA54.98 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.20
LogP ≤ 51.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

6,7-dimethoxy-3H-quinazolin-4-one;formamide
CID 158241473
6-acetyl-7-methoxy-3H-quinazolin-4-one
CID 137176609
7-(2-chloroethoxy)-6-methoxy-3H-quinazolin-4-one
CID 135589778
6-methoxy-7-[2-(2-methoxyethoxy)ethoxy]-3H-quinazolin-4-one
CID 135742285
6,7-bis(2-methoxyethoxy)-3H-quinazolin-4-one;ethane
CID 143274794
6-methoxy-7-(2-methylsulfanylethoxy)-3H-quinazolin-4-one;hydrochloride
CID 135549386
6-methoxy-7-(2-pyrrol-1-ylethoxy)-3H-quinazolin-4-one
CID 135442261
6-fluoro-8-methoxy-3H-quinazolin-4-one
CID 136677465
7-(2-imidazol-1-ylethoxy)-6-methoxy-3H-quinazolin-4-one
CID 135490844
6,7,8-trimethyl-3H-quinazolin-4-one
CID 137284029
7-[2-(1,1-dioxo-1,4-thiazinan-4-yl)ethoxy]-6-methoxy-3H-quinazolin-4-one
CID 135496860
ethane;7-methyl-3H-quinazolin-4-one
CID 143636831

Frequently Asked Questions

What is the IUPAC name of 7-methoxy-6-methyl-3H-quinazolin-4-one?
The IUPAC name of 7-methoxy-6-methyl-3H-quinazolin-4-one (CID 135980182) is 7-methoxy-6-methyl-3H-quinazolin-4-one.
What is the SMILES notation for 7-methoxy-6-methyl-3H-quinazolin-4-one?
The canonical SMILES for 7-methoxy-6-methyl-3H-quinazolin-4-one is COc1cc2nc[nH]c(=O)c2cc1C.
What is the InChIKey of 7-methoxy-6-methyl-3H-quinazolin-4-one?
The InChIKey is LEOCYDAZDIEWMV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10N2O2/c1-6-3-7-8(4-9(6)14-2)11-5-12-10(7)13/h3-5H,1-2H3,(H,11,12,13).
What are the key properties of 7-methoxy-6-methyl-3H-quinazolin-4-one?
7-methoxy-6-methyl-3H-quinazolin-4-one has a molecular weight of 190.20 g/mol, XLogP of 1.24, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 7-methoxy-6-methyl-3H-quinazolin-4-one is sourced from PubChem (CID 135980182), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).