8-bromo-6-fluoro-3-methylquinolin-2-amine

C10H8BrFN2 — CID 63232268

IUPAC8-bromo-6-fluoro-3-methylquinolin-2-amine
SMILESCc1cc2cc(F)cc(Br)c2nc1N
InChIInChI=1S/C10H8BrFN2/c1-5-2-6-3-7(12)4-8(11)9(6)14-10(5)13/h2-4H,1H3,(H2,13,14)
InChIKeyYBRXHYRVKSIHKG-UHFFFAOYSA-N
MW255.09 g/mol
LogP3.03
Rot. Bonds

About 8-bromo-6-fluoro-3-methylquinolin-2-amine

8-bromo-6-fluoro-3-methylquinolin-2-amine (PubChem CID 63232268) has the molecular formula C10H8BrFN2 and a molecular weight of 255.09 g/mol. Its IUPAC name is 8-bromo-6-fluoro-3-methylquinolin-2-amine.

Molecular Properties

Compound Name8-bromo-6-fluoro-3-methylquinolin-2-amine
PubChem CID63232268
Molecular FormulaC10H8BrFN2
Molecular Weight255.09 g/mol
Exact Mass253.99
IUPAC Name8-bromo-6-fluoro-3-methylquinolin-2-amine
SMILESCc1cc2cc(F)cc(Br)c2nc1N
InChIInChI=1S/C10H8BrFN2/c1-5-2-6-3-7(12)4-8(11)9(6)14-10(5)13/h2-4H,1H3,(H2,13,14)
InChIKeyYBRXHYRVKSIHKG-UHFFFAOYSA-N
XLogP3.03
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.09
LogP ≤ 53.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 8-bromo-6-fluoro-3-methylquinolin-2-amine?
The IUPAC name of 8-bromo-6-fluoro-3-methylquinolin-2-amine (CID 63232268) is 8-bromo-6-fluoro-3-methylquinolin-2-amine.
What is the SMILES notation for 8-bromo-6-fluoro-3-methylquinolin-2-amine?
The canonical SMILES for 8-bromo-6-fluoro-3-methylquinolin-2-amine is Cc1cc2cc(F)cc(Br)c2nc1N.
What is the InChIKey of 8-bromo-6-fluoro-3-methylquinolin-2-amine?
The InChIKey is YBRXHYRVKSIHKG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8BrFN2/c1-5-2-6-3-7(12)4-8(11)9(6)14-10(5)13/h2-4H,1H3,(H2,13,14).
What are the key properties of 8-bromo-6-fluoro-3-methylquinolin-2-amine?
8-bromo-6-fluoro-3-methylquinolin-2-amine has a molecular weight of 255.09 g/mol, XLogP of 3.03, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 8-bromo-6-fluoro-3-methylquinolin-2-amine is sourced from PubChem (CID 63232268), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).