6,7,8-trimethoxy-4-methylquinazoline

C12H14N2O3 — CID 70672853

IUPAC6,7,8-trimethoxy-4-methylquinazoline
SMILESCOc1cc2c(C)ncnc2c(OC)c1OC
InChIInChI=1S/C12H14N2O3/c1-7-8-5-9(15-2)11(16-3)12(17-4)10(8)14-6-13-7/h5-6H,1-4H3
InChIKeySDXONSKHIYMJKU-UHFFFAOYSA-N
MW234.25 g/mol
LogP1.96
Rot. Bonds3

About 6,7,8-trimethoxy-4-methylquinazoline

6,7,8-trimethoxy-4-methylquinazoline (PubChem CID 70672853) has the molecular formula C12H14N2O3 and a molecular weight of 234.25 g/mol. Its IUPAC name is 6,7,8-trimethoxy-4-methylquinazoline.

Molecular Properties

Compound Name6,7,8-trimethoxy-4-methylquinazoline
PubChem CID70672853
Molecular FormulaC12H14N2O3
Molecular Weight234.25 g/mol
Exact Mass234.10
IUPAC Name6,7,8-trimethoxy-4-methylquinazoline
SMILESCOc1cc2c(C)ncnc2c(OC)c1OC
InChIInChI=1S/C12H14N2O3/c1-7-8-5-9(15-2)11(16-3)12(17-4)10(8)14-6-13-7/h5-6H,1-4H3
InChIKeySDXONSKHIYMJKU-UHFFFAOYSA-N
XLogP1.96
TPSA53.47 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.25
LogP ≤ 51.96
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

6,7,8-trimethoxy-N,N-dimethylquinazolin-4-amine
CID 110433384
6,7-dimethoxy-4-methylquinazoline
CID 4319422
4-(azepan-1-yl)-6,7,8-trimethoxyquinazoline
CID 110433392
2-[2-hydroxyethyl-(6,7,8-trimethoxyquinazolin-4-yl)amino]ethanol
CID 110433388
2-(8-methoxy-4-methylquinazolin-6-yl)-5-methyl-1,3-thiazole
CID 155354082
4-(3,5-dimethylpiperidin-1-yl)-6,7,8-trimethoxyquinazoline
CID 110433380
ethane;4-methoxy-8-methyl-[1,3]dioxolo[4,5-g]quinazoline
CID 142542894
6-(5-fluoropyrimidin-2-yl)-8-methoxy-4-methylquinazoline
CID 155354002
N-benzyl-6,7,8-trimethoxyquinazolin-4-amine
CID 18796773
N-[(4-chlorophenyl)methyl]-6,7,8-trimethoxyquinazolin-4-amine
CID 11710213
4-(benzimidazol-1-yl)-6,7,8-trimethoxyquinazoline
CID 110435786
N-(4-bromo-2-chlorophenyl)-6,7,8-trimethoxyquinazolin-4-amine
CID 24767185

Frequently Asked Questions

What is the IUPAC name of 6,7,8-trimethoxy-4-methylquinazoline?
The IUPAC name of 6,7,8-trimethoxy-4-methylquinazoline (CID 70672853) is 6,7,8-trimethoxy-4-methylquinazoline.
What is the SMILES notation for 6,7,8-trimethoxy-4-methylquinazoline?
The canonical SMILES for 6,7,8-trimethoxy-4-methylquinazoline is COc1cc2c(C)ncnc2c(OC)c1OC.
What is the InChIKey of 6,7,8-trimethoxy-4-methylquinazoline?
The InChIKey is SDXONSKHIYMJKU-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N2O3/c1-7-8-5-9(15-2)11(16-3)12(17-4)10(8)14-6-13-7/h5-6H,1-4H3.
What are the key properties of 6,7,8-trimethoxy-4-methylquinazoline?
6,7,8-trimethoxy-4-methylquinazoline has a molecular weight of 234.25 g/mol, XLogP of 1.96, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6,7,8-trimethoxy-4-methylquinazoline is sourced from PubChem (CID 70672853), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).