(8-bromo-6-fluoroquinolin-2-yl)methanamine

C10H8BrFN2 — CID 130172047

IUPAC(8-bromo-6-fluoroquinolin-2-yl)methanamine
SMILESNCc1ccc2cc(F)cc(Br)c2n1
InChIInChI=1S/C10H8BrFN2/c11-9-4-7(12)3-6-1-2-8(5-13)14-10(6)9/h1-4H,5,13H2
InChIKeyIZSRGMXHNMUQOA-UHFFFAOYSA-N
MW255.09 g/mol
LogP2.60
Rot. Bonds1

About (8-bromo-6-fluoroquinolin-2-yl)methanamine

(8-bromo-6-fluoroquinolin-2-yl)methanamine (PubChem CID 130172047) has the molecular formula C10H8BrFN2 and a molecular weight of 255.09 g/mol. Its IUPAC name is (8-bromo-6-fluoroquinolin-2-yl)methanamine.

Molecular Properties

Compound Name(8-bromo-6-fluoroquinolin-2-yl)methanamine
PubChem CID130172047
Molecular FormulaC10H8BrFN2
Molecular Weight255.09 g/mol
Exact Mass253.99
IUPAC Name(8-bromo-6-fluoroquinolin-2-yl)methanamine
SMILESNCc1ccc2cc(F)cc(Br)c2n1
InChIInChI=1S/C10H8BrFN2/c11-9-4-7(12)3-6-1-2-8(5-13)14-10(6)9/h1-4H,5,13H2
InChIKeyIZSRGMXHNMUQOA-UHFFFAOYSA-N
XLogP2.60
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.09
LogP ≤ 52.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-ethyl-6,8-difluoroquinoline
CID 51361067
(5-bromo-7-fluoronaphthalen-2-yl)methanamine
CID 135396100
6,8-dibromo-2-butylquinoline
CID 11810047
(6-fluoro-2-methylquinolin-8-yl)methanamine
CID 82573593
(8-chloro-5-fluoroquinolin-2-yl)methanamine
CID 107532023
(8-fluoro-5-methylquinolin-2-yl)methanamine
CID 102941388
8-bromo-2-chloro-3-ethyl-6-fluoroquinoline
CID 63231922
(8-fluoro-5-methoxyquinolin-2-yl)methanamine
CID 102941402
8-bromo-2-chloro-6-fluoro-3-methylquinoline
CID 63231876
2-(aminomethyl)-3-bromo-5-fluorophenol
CID 119001457
2-(aminomethyl)quinolin-8-amine
CID 11715256
3-(6,8-difluoroquinolin-2-yl)-2-methylpropanoic acid
CID 82244963

Frequently Asked Questions

What is the IUPAC name of (8-bromo-6-fluoroquinolin-2-yl)methanamine?
The IUPAC name of (8-bromo-6-fluoroquinolin-2-yl)methanamine (CID 130172047) is (8-bromo-6-fluoroquinolin-2-yl)methanamine.
What is the SMILES notation for (8-bromo-6-fluoroquinolin-2-yl)methanamine?
The canonical SMILES for (8-bromo-6-fluoroquinolin-2-yl)methanamine is NCc1ccc2cc(F)cc(Br)c2n1.
What is the InChIKey of (8-bromo-6-fluoroquinolin-2-yl)methanamine?
The InChIKey is IZSRGMXHNMUQOA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8BrFN2/c11-9-4-7(12)3-6-1-2-8(5-13)14-10(6)9/h1-4H,5,13H2.
What are the key properties of (8-bromo-6-fluoroquinolin-2-yl)methanamine?
(8-bromo-6-fluoroquinolin-2-yl)methanamine has a molecular weight of 255.09 g/mol, XLogP of 2.60, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (8-bromo-6-fluoroquinolin-2-yl)methanamine is sourced from PubChem (CID 130172047), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).