6-bromo-8-methoxy-4-methylquinazolin-2-amine

C10H10BrN3O — CID 135197532

IUPAC6-bromo-8-methoxy-4-methylquinazolin-2-amine
SMILESCOc1cc(Br)cc2c(C)nc(N)nc12
InChIInChI=1S/C10H10BrN3O/c1-5-7-3-6(11)4-8(15-2)9(7)14-10(12)13-5/h3-4H,1-2H3,(H2,12,13,14)
InChIKeyAPQZAGXYTZHBOD-UHFFFAOYSA-N
MW268.11 g/mol
LogP2.29
Rot. Bonds1

About 6-bromo-8-methoxy-4-methylquinazolin-2-amine

6-bromo-8-methoxy-4-methylquinazolin-2-amine (PubChem CID 135197532) has the molecular formula C10H10BrN3O and a molecular weight of 268.11 g/mol. Its IUPAC name is 6-bromo-8-methoxy-4-methylquinazolin-2-amine.

Molecular Properties

Compound Name6-bromo-8-methoxy-4-methylquinazolin-2-amine
PubChem CID135197532
Molecular FormulaC10H10BrN3O
Molecular Weight268.11 g/mol
Exact Mass267.00
IUPAC Name6-bromo-8-methoxy-4-methylquinazolin-2-amine
SMILESCOc1cc(Br)cc2c(C)nc(N)nc12
InChIInChI=1S/C10H10BrN3O/c1-5-7-3-6(11)4-8(15-2)9(7)14-10(12)13-5/h3-4H,1-2H3,(H2,12,13,14)
InChIKeyAPQZAGXYTZHBOD-UHFFFAOYSA-N
XLogP2.29
TPSA61.03 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.11
LogP ≤ 52.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-bromo-8-methoxy-4-methylquinazolin-2-amine?
The IUPAC name of 6-bromo-8-methoxy-4-methylquinazolin-2-amine (CID 135197532) is 6-bromo-8-methoxy-4-methylquinazolin-2-amine.
What is the SMILES notation for 6-bromo-8-methoxy-4-methylquinazolin-2-amine?
The canonical SMILES for 6-bromo-8-methoxy-4-methylquinazolin-2-amine is COc1cc(Br)cc2c(C)nc(N)nc12.
What is the InChIKey of 6-bromo-8-methoxy-4-methylquinazolin-2-amine?
The InChIKey is APQZAGXYTZHBOD-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10BrN3O/c1-5-7-3-6(11)4-8(15-2)9(7)14-10(12)13-5/h3-4H,1-2H3,(H2,12,13,14).
What are the key properties of 6-bromo-8-methoxy-4-methylquinazolin-2-amine?
6-bromo-8-methoxy-4-methylquinazolin-2-amine has a molecular weight of 268.11 g/mol, XLogP of 2.29, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-bromo-8-methoxy-4-methylquinazolin-2-amine is sourced from PubChem (CID 135197532), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).