3-ethyl-6-methylquinazolin-4-one

C11H12N2O — CID 70641598

IUPAC3-ethyl-6-methylquinazolin-4-one
SMILESCCn1cnc2ccc(C)cc2c1=O
InChIInChI=1S/C11H12N2O/c1-3-13-7-12-10-5-4-8(2)6-9(10)11(13)14/h4-7H,3H2,1-2H3
InChIKeyNSHYBFYBTYHYTO-UHFFFAOYSA-N
MW188.23 g/mol
LogP1.72
Rot. Bonds1

About 3-ethyl-6-methylquinazolin-4-one

3-ethyl-6-methylquinazolin-4-one (PubChem CID 70641598) has the molecular formula C11H12N2O and a molecular weight of 188.23 g/mol. Its IUPAC name is 3-ethyl-6-methylquinazolin-4-one.

Molecular Properties

Compound Name3-ethyl-6-methylquinazolin-4-one
PubChem CID70641598
Molecular FormulaC11H12N2O
Molecular Weight188.23 g/mol
Exact Mass188.09
IUPAC Name3-ethyl-6-methylquinazolin-4-one
SMILESCCn1cnc2ccc(C)cc2c1=O
InChIInChI=1S/C11H12N2O/c1-3-13-7-12-10-5-4-8(2)6-9(10)11(13)14/h4-7H,3H2,1-2H3
InChIKeyNSHYBFYBTYHYTO-UHFFFAOYSA-N
XLogP1.72
TPSA34.89 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.23
LogP ≤ 51.72
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

6-methyl-3-(methylaminomethyl)quinazolin-4-one
CID 117264007
3-(3,3-dimethyl-2-oxobutyl)-6-methylquinazolin-4-one
CID 47037899
3-(2-hydroxypropyl)-7-methylquinazolin-4-one
CID 117264166
3-[(2-chloro-4-methylphenyl)methyl]-6-iodoquinazolin-4-one
CID 106870858
N-cyclopropyl-3-ethyl-4-oxoquinazoline-6-carboxamide
CID 53015892
3-(2-aminoethyl)-7-methylquinazolin-4-one
CID 117264406
3-(2-hydroxyethyl)-7-methylquinazolin-4-one
CID 117264165
1-(4-acetylphenyl)-3-(3-ethyl-4-oxoquinazolin-6-yl)urea
CID 162429338
N,N-dicyclohexyl-2-(6-methyl-4-oxoquinazolin-3-yl)acetamide
CID 46484188
3-[[4-amino-6-(dimethylamino)-1,3,5-triazin-2-yl]methyl]-6-methylquinazolin-4-one
CID 46484186
6-bromo-3-[2-(2,4-dimethylphenyl)-2-oxoethyl]quinazolin-4-one
CID 7488393
3-[(2,5-dimethylphenyl)methyl]-6-nitroquinazolin-4-one
CID 7694878

Frequently Asked Questions

What is the IUPAC name of 3-ethyl-6-methylquinazolin-4-one?
The IUPAC name of 3-ethyl-6-methylquinazolin-4-one (CID 70641598) is 3-ethyl-6-methylquinazolin-4-one.
What is the SMILES notation for 3-ethyl-6-methylquinazolin-4-one?
The canonical SMILES for 3-ethyl-6-methylquinazolin-4-one is CCn1cnc2ccc(C)cc2c1=O.
What is the InChIKey of 3-ethyl-6-methylquinazolin-4-one?
The InChIKey is NSHYBFYBTYHYTO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12N2O/c1-3-13-7-12-10-5-4-8(2)6-9(10)11(13)14/h4-7H,3H2,1-2H3.
What are the key properties of 3-ethyl-6-methylquinazolin-4-one?
3-ethyl-6-methylquinazolin-4-one has a molecular weight of 188.23 g/mol, XLogP of 1.72, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethyl-6-methylquinazolin-4-one is sourced from PubChem (CID 70641598), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).