8-methoxy-3-(2-methylphenyl)-1H-quinazoline-2,4-dione

C16H14N2O3 — CID 117261966

IUPAC8-methoxy-3-(2-methylphenyl)-1H-quinazoline-2,4-dione
SMILESCOc1cccc2c(=O)n(-c3ccccc3C)c(=O)[nH]c12
InChIInChI=1S/C16H14N2O3/c1-10-6-3-4-8-12(10)18-15(19)11-7-5-9-13(21-2)14(11)17-16(18)20/h3-9H,1-2H3,(H,17,20)
InChIKeyFGCZHHJSQYCLCM-UHFFFAOYSA-N
MW282.30 g/mol
LogP2.00
Rot. Bonds2

About 8-methoxy-3-(2-methylphenyl)-1H-quinazoline-2,4-dione

8-methoxy-3-(2-methylphenyl)-1H-quinazoline-2,4-dione (PubChem CID 117261966) has the molecular formula C16H14N2O3 and a molecular weight of 282.30 g/mol. Its IUPAC name is 8-methoxy-3-(2-methylphenyl)-1H-quinazoline-2,4-dione.

Molecular Properties

Compound Name8-methoxy-3-(2-methylphenyl)-1H-quinazoline-2,4-dione
PubChem CID117261966
Molecular FormulaC16H14N2O3
Molecular Weight282.30 g/mol
Exact Mass282.10
IUPAC Name8-methoxy-3-(2-methylphenyl)-1H-quinazoline-2,4-dione
SMILESCOc1cccc2c(=O)n(-c3ccccc3C)c(=O)[nH]c12
InChIInChI=1S/C16H14N2O3/c1-10-6-3-4-8-12(10)18-15(19)11-7-5-9-13(21-2)14(11)17-16(18)20/h3-9H,1-2H3,(H,17,20)
InChIKeyFGCZHHJSQYCLCM-UHFFFAOYSA-N
XLogP2.00
TPSA64.09 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.30
LogP ≤ 52.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-(2-chlorophenyl)-8-methoxy-1H-quinazoline-2,4-dione
CID 117261970
8-methoxy-3-(3-methylphenyl)-1H-quinazoline-2,4-dione
CID 117261941
8-methoxy-3-(5-methylthiophen-2-yl)-1H-quinazoline-2,4-dione
CID 117261861
7-methoxy-3-(2-methoxyphenyl)-1H-benzimidazol-2-one
CID 19771132
3-(2-bromophenyl)-7-methoxy-1H-benzimidazol-2-one
CID 117206866
3-(4-methoxyphenyl)-8-methyl-1H-quinazoline-2,4-dione
CID 117261977
8-methoxy-3-(2-methylpropyl)-1H-quinazoline-2,4-dione
CID 117261904
8-methoxy-3-propyl-1H-quinazoline-2,4-dione
CID 117261902
8-chloro-3-(2-chlorophenyl)-1H-quinazoline-2,4-dione
CID 117261960
6-hydroxy-3-(2-methoxyphenyl)-1H-quinazoline-2,4-dione
CID 117261398
3-(3-aminopropyl)-8-methoxy-1H-quinazoline-2,4-dione
CID 117263372
3-(2-aminopropyl)-8-methoxy-1H-quinazoline-2,4-dione
CID 117263341

Frequently Asked Questions

What is the IUPAC name of 8-methoxy-3-(2-methylphenyl)-1H-quinazoline-2,4-dione?
The IUPAC name of 8-methoxy-3-(2-methylphenyl)-1H-quinazoline-2,4-dione (CID 117261966) is 8-methoxy-3-(2-methylphenyl)-1H-quinazoline-2,4-dione.
What is the SMILES notation for 8-methoxy-3-(2-methylphenyl)-1H-quinazoline-2,4-dione?
The canonical SMILES for 8-methoxy-3-(2-methylphenyl)-1H-quinazoline-2,4-dione is COc1cccc2c(=O)n(-c3ccccc3C)c(=O)[nH]c12.
What is the InChIKey of 8-methoxy-3-(2-methylphenyl)-1H-quinazoline-2,4-dione?
The InChIKey is FGCZHHJSQYCLCM-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14N2O3/c1-10-6-3-4-8-12(10)18-15(19)11-7-5-9-13(21-2)14(11)17-16(18)20/h3-9H,1-2H3,(H,17,20).
What are the key properties of 8-methoxy-3-(2-methylphenyl)-1H-quinazoline-2,4-dione?
8-methoxy-3-(2-methylphenyl)-1H-quinazoline-2,4-dione has a molecular weight of 282.30 g/mol, XLogP of 2.00, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 8-methoxy-3-(2-methylphenyl)-1H-quinazoline-2,4-dione is sourced from PubChem (CID 117261966), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).