3-bromo-5-chloro-6-(difluoromethyl)pyridin-2-amine

C6H4BrClF2N2 — CID 119012391

IUPAC3-bromo-5-chloro-6-(difluoromethyl)pyridin-2-amine
SMILESNc1nc(C(F)F)c(Cl)cc1Br
InChIInChI=1S/C6H4BrClF2N2/c7-2-1-3(8)4(5(9)10)12-6(2)11/h1,5H,(H2,11,12)
InChIKeyNTTJWTFSTAHCQY-UHFFFAOYSA-N
MW257.46 g/mol
LogP3.02
Rot. Bonds1

About 3-bromo-5-chloro-6-(difluoromethyl)pyridin-2-amine

3-bromo-5-chloro-6-(difluoromethyl)pyridin-2-amine (PubChem CID 119012391) has the molecular formula C6H4BrClF2N2 and a molecular weight of 257.46 g/mol. Its IUPAC name is 3-bromo-5-chloro-6-(difluoromethyl)pyridin-2-amine.

Molecular Properties

Compound Name3-bromo-5-chloro-6-(difluoromethyl)pyridin-2-amine
PubChem CID119012391
Molecular FormulaC6H4BrClF2N2
Molecular Weight257.46 g/mol
Exact Mass255.92
IUPAC Name3-bromo-5-chloro-6-(difluoromethyl)pyridin-2-amine
SMILESNc1nc(C(F)F)c(Cl)cc1Br
InChIInChI=1S/C6H4BrClF2N2/c7-2-1-3(8)4(5(9)10)12-6(2)11/h1,5H,(H2,11,12)
InChIKeyNTTJWTFSTAHCQY-UHFFFAOYSA-N
XLogP3.02
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.46
LogP ≤ 53.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-amino-5-chloro-6-(difluoromethyl)pyridine-3-sulfonyl chloride
CID 130103068
2-bromo-5-chloro-6-(difluoromethyl)-3-fluoropyridine
CID 118997697
3-bromo-5-(difluoromethyl)-6-fluoropyridin-2-amine
CID 118999087
5-chloro-6-(difluoromethyl)-2-fluoropyridin-3-amine
CID 130102453
6-bromo-4-chloro-2-(difluoromethyl)pyridin-3-amine
CID 130101605
2-amino-5-bromo-6-(difluoromethyl)pyridine-3-carbaldehyde
CID 119014492
4-bromo-3-chloro-6-(difluoromethyl)pyridin-2-amine
CID 118995060
ethyl 2-[6-amino-5-bromo-2-(difluoromethyl)-3-pyridinyl]acetate
CID 134658560
6-amino-5-chloro-2-(difluoromethyl)pyridine-3-carbonyl chloride
CID 130103005
3,4-dibromo-6-chloro-2-(difluoromethyl)pyridine
CID 130098856
5-chloro-6-(difluoromethyl)-3-iodopyridine-2-sulfonamide
CID 130073589
2-(bromomethyl)-5-chloro-6-(difluoromethyl)-3-fluoropyridine
CID 130071737

Frequently Asked Questions

What is the IUPAC name of 3-bromo-5-chloro-6-(difluoromethyl)pyridin-2-amine?
The IUPAC name of 3-bromo-5-chloro-6-(difluoromethyl)pyridin-2-amine (CID 119012391) is 3-bromo-5-chloro-6-(difluoromethyl)pyridin-2-amine.
What is the SMILES notation for 3-bromo-5-chloro-6-(difluoromethyl)pyridin-2-amine?
The canonical SMILES for 3-bromo-5-chloro-6-(difluoromethyl)pyridin-2-amine is Nc1nc(C(F)F)c(Cl)cc1Br.
What is the InChIKey of 3-bromo-5-chloro-6-(difluoromethyl)pyridin-2-amine?
The InChIKey is NTTJWTFSTAHCQY-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H4BrClF2N2/c7-2-1-3(8)4(5(9)10)12-6(2)11/h1,5H,(H2,11,12).
What are the key properties of 3-bromo-5-chloro-6-(difluoromethyl)pyridin-2-amine?
3-bromo-5-chloro-6-(difluoromethyl)pyridin-2-amine has a molecular weight of 257.46 g/mol, XLogP of 3.02, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-bromo-5-chloro-6-(difluoromethyl)pyridin-2-amine is sourced from PubChem (CID 119012391), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).