7-bromo-2-methylquinazoline

C9H7BrN2 — CID 22607818

IUPAC7-bromo-2-methylquinazoline
SMILESCc1ncc2ccc(Br)cc2n1
InChIInChI=1S/C9H7BrN2/c1-6-11-5-7-2-3-8(10)4-9(7)12-6/h2-5H,1H3
InChIKeyFUJPMAXZVVBVEY-UHFFFAOYSA-N
MW223.07 g/mol
LogP2.70
Rot. Bonds

About 7-bromo-2-methylquinazoline

7-bromo-2-methylquinazoline (PubChem CID 22607818) has the molecular formula C9H7BrN2 and a molecular weight of 223.07 g/mol. Its IUPAC name is 7-bromo-2-methylquinazoline.

Molecular Properties

Compound Name7-bromo-2-methylquinazoline
PubChem CID22607818
Molecular FormulaC9H7BrN2
Molecular Weight223.07 g/mol
Exact Mass221.98
IUPAC Name7-bromo-2-methylquinazoline
SMILESCc1ncc2ccc(Br)cc2n1
InChIInChI=1S/C9H7BrN2/c1-6-11-5-7-2-3-8(10)4-9(7)12-6/h2-5H,1H3
InChIKeyFUJPMAXZVVBVEY-UHFFFAOYSA-N
XLogP2.70
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.07
LogP ≤ 52.70
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 7-bromo-2-methylquinazoline?
The IUPAC name of 7-bromo-2-methylquinazoline (CID 22607818) is 7-bromo-2-methylquinazoline.
What is the SMILES notation for 7-bromo-2-methylquinazoline?
The canonical SMILES for 7-bromo-2-methylquinazoline is Cc1ncc2ccc(Br)cc2n1.
What is the InChIKey of 7-bromo-2-methylquinazoline?
The InChIKey is FUJPMAXZVVBVEY-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H7BrN2/c1-6-11-5-7-2-3-8(10)4-9(7)12-6/h2-5H,1H3.
What are the key properties of 7-bromo-2-methylquinazoline?
7-bromo-2-methylquinazoline has a molecular weight of 223.07 g/mol, XLogP of 2.70, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7-bromo-2-methylquinazoline is sourced from PubChem (CID 22607818), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).