6-bromo-8-ethyl-7-fluoroquinazolin-2-amine

C10H9BrFN3 — CID 138676755

IUPAC6-bromo-8-ethyl-7-fluoroquinazolin-2-amine
SMILESCCc1c(F)c(Br)cc2cnc(N)nc12
InChIInChI=1S/C10H9BrFN3/c1-2-6-8(12)7(11)3-5-4-14-10(13)15-9(5)6/h3-4H,2H2,1H3,(H2,13,14,15)
InChIKeyUXEJSZDVRNTOLZ-UHFFFAOYSA-N
MW270.10 g/mol
LogP2.68
Rot. Bonds1

About 6-bromo-8-ethyl-7-fluoroquinazolin-2-amine

6-bromo-8-ethyl-7-fluoroquinazolin-2-amine (PubChem CID 138676755) has the molecular formula C10H9BrFN3 and a molecular weight of 270.10 g/mol. Its IUPAC name is 6-bromo-8-ethyl-7-fluoroquinazolin-2-amine.

Molecular Properties

Compound Name6-bromo-8-ethyl-7-fluoroquinazolin-2-amine
PubChem CID138676755
Molecular FormulaC10H9BrFN3
Molecular Weight270.10 g/mol
Exact Mass269.00
IUPAC Name6-bromo-8-ethyl-7-fluoroquinazolin-2-amine
SMILESCCc1c(F)c(Br)cc2cnc(N)nc12
InChIInChI=1S/C10H9BrFN3/c1-2-6-8(12)7(11)3-5-4-14-10(13)15-9(5)6/h3-4H,2H2,1H3,(H2,13,14,15)
InChIKeyUXEJSZDVRNTOLZ-UHFFFAOYSA-N
XLogP2.68
TPSA51.80 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.10
LogP ≤ 52.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 6-bromo-8-ethyl-7-fluoroquinazolin-2-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 6-bromo-8-ethyl-7-fluoroquinazolin-2-amine?
The IUPAC name of 6-bromo-8-ethyl-7-fluoroquinazolin-2-amine (CID 138676755) is 6-bromo-8-ethyl-7-fluoroquinazolin-2-amine.
What is the SMILES notation for 6-bromo-8-ethyl-7-fluoroquinazolin-2-amine?
The canonical SMILES for 6-bromo-8-ethyl-7-fluoroquinazolin-2-amine is CCc1c(F)c(Br)cc2cnc(N)nc12.
What is the InChIKey of 6-bromo-8-ethyl-7-fluoroquinazolin-2-amine?
The InChIKey is UXEJSZDVRNTOLZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9BrFN3/c1-2-6-8(12)7(11)3-5-4-14-10(13)15-9(5)6/h3-4H,2H2,1H3,(H2,13,14,15).
What are the key properties of 6-bromo-8-ethyl-7-fluoroquinazolin-2-amine?
6-bromo-8-ethyl-7-fluoroquinazolin-2-amine has a molecular weight of 270.10 g/mol, XLogP of 2.68, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-bromo-8-ethyl-7-fluoroquinazolin-2-amine is sourced from PubChem (CID 138676755), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).