6-bromo-2-(2-fluorophenyl)quinazolin-4-amine

C14H9BrFN3 — CID 64983634

IUPAC6-bromo-2-(2-fluorophenyl)quinazolin-4-amine
SMILESNc1nc(-c2ccccc2F)nc2ccc(Br)cc12
InChIInChI=1S/C14H9BrFN3/c15-8-5-6-12-10(7-8)13(17)19-14(18-12)9-3-1-2-4-11(9)16/h1-7H,(H2,17,18,19)
InChIKeyHYBICEYOZROIFQ-UHFFFAOYSA-N
MW318.15 g/mol
LogP3.78
Rot. Bonds1

About 6-bromo-2-(2-fluorophenyl)quinazolin-4-amine

6-bromo-2-(2-fluorophenyl)quinazolin-4-amine (PubChem CID 64983634) has the molecular formula C14H9BrFN3 and a molecular weight of 318.15 g/mol. Its IUPAC name is 6-bromo-2-(2-fluorophenyl)quinazolin-4-amine.

Molecular Properties

Compound Name6-bromo-2-(2-fluorophenyl)quinazolin-4-amine
PubChem CID64983634
Molecular FormulaC14H9BrFN3
Molecular Weight318.15 g/mol
Exact Mass317.00
IUPAC Name6-bromo-2-(2-fluorophenyl)quinazolin-4-amine
SMILESNc1nc(-c2ccccc2F)nc2ccc(Br)cc12
InChIInChI=1S/C14H9BrFN3/c15-8-5-6-12-10(7-8)13(17)19-14(18-12)9-3-1-2-4-11(9)16/h1-7H,(H2,17,18,19)
InChIKeyHYBICEYOZROIFQ-UHFFFAOYSA-N
XLogP3.78
TPSA51.80 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500318.15
LogP ≤ 53.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6-bromo-2-(2-fluorophenyl)quinazolin-4-amine?
The IUPAC name of 6-bromo-2-(2-fluorophenyl)quinazolin-4-amine (CID 64983634) is 6-bromo-2-(2-fluorophenyl)quinazolin-4-amine.
What is the SMILES notation for 6-bromo-2-(2-fluorophenyl)quinazolin-4-amine?
The canonical SMILES for 6-bromo-2-(2-fluorophenyl)quinazolin-4-amine is Nc1nc(-c2ccccc2F)nc2ccc(Br)cc12.
What is the InChIKey of 6-bromo-2-(2-fluorophenyl)quinazolin-4-amine?
The InChIKey is HYBICEYOZROIFQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H9BrFN3/c15-8-5-6-12-10(7-8)13(17)19-14(18-12)9-3-1-2-4-11(9)16/h1-7H,(H2,17,18,19).
What are the key properties of 6-bromo-2-(2-fluorophenyl)quinazolin-4-amine?
6-bromo-2-(2-fluorophenyl)quinazolin-4-amine has a molecular weight of 318.15 g/mol, XLogP of 3.78, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-bromo-2-(2-fluorophenyl)quinazolin-4-amine is sourced from PubChem (CID 64983634), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).