5-bromo-2-(difluoromethyl)-3-methylpyridine

C7H6BrF2N — CID 130095050

IUPAC5-bromo-2-(difluoromethyl)-3-methylpyridine
SMILESCc1cc(Br)cnc1C(F)F
InChIInChI=1S/C7H6BrF2N/c1-4-2-5(8)3-11-6(4)7(9)10/h2-3,7H,1H3
InChIKeySAYQIHJISYNBEB-UHFFFAOYSA-N
MW222.03 g/mol
LogP3.09
Rot. Bonds1

About 5-bromo-2-(difluoromethyl)-3-methylpyridine

5-bromo-2-(difluoromethyl)-3-methylpyridine (PubChem CID 130095050) has the molecular formula C7H6BrF2N and a molecular weight of 222.03 g/mol. Its IUPAC name is 5-bromo-2-(difluoromethyl)-3-methylpyridine.

Molecular Properties

Compound Name5-bromo-2-(difluoromethyl)-3-methylpyridine
PubChem CID130095050
Molecular FormulaC7H6BrF2N
Molecular Weight222.03 g/mol
Exact Mass220.97
IUPAC Name5-bromo-2-(difluoromethyl)-3-methylpyridine
SMILESCc1cc(Br)cnc1C(F)F
InChIInChI=1S/C7H6BrF2N/c1-4-2-5(8)3-11-6(4)7(9)10/h2-3,7H,1H3
InChIKeySAYQIHJISYNBEB-UHFFFAOYSA-N
XLogP3.09
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.03
LogP ≤ 53.09
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

(1S,2R)-1-amino-1-(5-bromo-3-methyl-2-pyridinyl)propan-2-ol
CID 130840689
5-bromo-2-(difluoromethyl)-3-iodopyridine
CID 130095025
5-bromo-2-(difluoromethyl)pyridin-3-amine
CID 130094563
3-(5-bromo-3-methyl-2-pyridinyl)butan-2-amine
CID 79718137
[6-(difluoromethyl)-5-methyl-3-pyridinyl]oxyboronic acid
CID 177254543
6-(difluoromethyl)-5-methylpyridine-3-carbonitrile
CID 130095854
5-bromo-2-(difluoromethyl)pyridine-3-sulfonamide
CID 130095356
2-(5-bromo-3-methyl-2-pyridinyl)-N-propylpentan-3-amine
CID 79718140
3-bromo-2-(difluoromethyl)-5-methylpyridine-4-carbaldehyde
CID 130069374
2-bromo-4-(difluoromethyl)-5-methylpyridine
CID 130095038
acetylene;5-bromo-3-methylpyridin-2-amine
CID 143713181
2-(difluoromethyl)-3-iodo-4,5-dimethylpyridine
CID 130101179

Frequently Asked Questions

What is the IUPAC name of 5-bromo-2-(difluoromethyl)-3-methylpyridine?
The IUPAC name of 5-bromo-2-(difluoromethyl)-3-methylpyridine (CID 130095050) is 5-bromo-2-(difluoromethyl)-3-methylpyridine.
What is the SMILES notation for 5-bromo-2-(difluoromethyl)-3-methylpyridine?
The canonical SMILES for 5-bromo-2-(difluoromethyl)-3-methylpyridine is Cc1cc(Br)cnc1C(F)F.
What is the InChIKey of 5-bromo-2-(difluoromethyl)-3-methylpyridine?
The InChIKey is SAYQIHJISYNBEB-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H6BrF2N/c1-4-2-5(8)3-11-6(4)7(9)10/h2-3,7H,1H3.
What are the key properties of 5-bromo-2-(difluoromethyl)-3-methylpyridine?
5-bromo-2-(difluoromethyl)-3-methylpyridine has a molecular weight of 222.03 g/mol, XLogP of 3.09, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-2-(difluoromethyl)-3-methylpyridine is sourced from PubChem (CID 130095050), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).