2-bromo-6-(trifluoromethyl)pyridin-3-amine

C6H4BrF3N2 — CID 14277710

IUPAC2-bromo-6-(trifluoromethyl)pyridin-3-amine
SMILESNc1ccc(C(F)(F)F)nc1Br
InChIInChI=1S/C6H4BrF3N2/c7-5-3(11)1-2-4(12-5)6(8,9)10/h1-2H,11H2
InChIKeyNCOWBQRCCMJSKW-UHFFFAOYSA-N
MW241.01 g/mol
LogP2.45
Rot. Bonds

About 2-bromo-6-(trifluoromethyl)pyridin-3-amine

2-bromo-6-(trifluoromethyl)pyridin-3-amine (PubChem CID 14277710) has the molecular formula C6H4BrF3N2 and a molecular weight of 241.01 g/mol. Its IUPAC name is 2-bromo-6-(trifluoromethyl)pyridin-3-amine.

Molecular Properties

Compound Name2-bromo-6-(trifluoromethyl)pyridin-3-amine
PubChem CID14277710
Molecular FormulaC6H4BrF3N2
Molecular Weight241.01 g/mol
Exact Mass239.95
IUPAC Name2-bromo-6-(trifluoromethyl)pyridin-3-amine
SMILESNc1ccc(C(F)(F)F)nc1Br
InChIInChI=1S/C6H4BrF3N2/c7-5-3(11)1-2-4(12-5)6(8,9)10/h1-2H,11H2
InChIKeyNCOWBQRCCMJSKW-UHFFFAOYSA-N
XLogP2.45
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.01
LogP ≤ 52.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

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Related Compounds

6-Bromopyridin-3-amine
CID 642811
3-Amino-2-bromopyridine
CID 642816
6-Bromo-2-methylpyridin-3-amine
CID 14418045
2-Bromo-6-fluoropyridin-3-amine
CID 57364127
2-Bromo-6-ethylpyridine
CID 12954800
2,6-Dimethyl-3-pyridylamine
CID 76964
2-Bromo-6-(trifluoromethyl)pyridine
CID 2782902
3-Amino-2-bromo-4,6-dimethylpyridine
CID 2049307
6-Bromo-2-chloropyridin-3-amine
CID 2050085
2-Bromo-6-methylpyridine
CID 79205
3-Amino-2,6-dibromopyridine
CID 817678
2-Chloro-6-(trifluoromethyl)pyridin-3-amine
CID 2737646

Frequently Asked Questions

What is the IUPAC name of 2-bromo-6-(trifluoromethyl)pyridin-3-amine?
The IUPAC name of 2-bromo-6-(trifluoromethyl)pyridin-3-amine (CID 14277710) is 2-bromo-6-(trifluoromethyl)pyridin-3-amine.
What is the SMILES notation for 2-bromo-6-(trifluoromethyl)pyridin-3-amine?
The canonical SMILES for 2-bromo-6-(trifluoromethyl)pyridin-3-amine is Nc1ccc(C(F)(F)F)nc1Br.
What is the InChIKey of 2-bromo-6-(trifluoromethyl)pyridin-3-amine?
The InChIKey is NCOWBQRCCMJSKW-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H4BrF3N2/c7-5-3(11)1-2-4(12-5)6(8,9)10/h1-2H,11H2.
What are the key properties of 2-bromo-6-(trifluoromethyl)pyridin-3-amine?
2-bromo-6-(trifluoromethyl)pyridin-3-amine has a molecular weight of 241.01 g/mol, XLogP of 2.45, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-bromo-6-(trifluoromethyl)pyridin-3-amine is sourced from PubChem (CID 14277710), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).