6-(difluoromethyl)-2-fluoro-3-methylpyridine

C7H6F3N — CID 130096225

IUPAC6-(difluoromethyl)-2-fluoro-3-methylpyridine
SMILESCc1ccc(C(F)F)nc1F
InChIInChI=1S/C7H6F3N/c1-4-2-3-5(6(8)9)11-7(4)10/h2-3,6H,1H3
InChIKeySRWORLXEJZCKMK-UHFFFAOYSA-N
MW161.13 g/mol
LogP2.47
Rot. Bonds1

About 6-(difluoromethyl)-2-fluoro-3-methylpyridine

6-(difluoromethyl)-2-fluoro-3-methylpyridine (PubChem CID 130096225) has the molecular formula C7H6F3N and a molecular weight of 161.13 g/mol. Its IUPAC name is 6-(difluoromethyl)-2-fluoro-3-methylpyridine.

Molecular Properties

Compound Name6-(difluoromethyl)-2-fluoro-3-methylpyridine
PubChem CID130096225
Molecular FormulaC7H6F3N
Molecular Weight161.13 g/mol
Exact Mass161.05
IUPAC Name6-(difluoromethyl)-2-fluoro-3-methylpyridine
SMILESCc1ccc(C(F)F)nc1F
InChIInChI=1S/C7H6F3N/c1-4-2-3-5(6(8)9)11-7(4)10/h2-3,6H,1H3
InChIKeySRWORLXEJZCKMK-UHFFFAOYSA-N
XLogP2.47
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500161.13
LogP ≤ 52.47
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

2-(chloromethyl)-6-(difluoromethyl)-3-methylpyridine
CID 130097601
2-fluoro-6-iodo-3-methylpyridine
CID 130895801
CID 171817518
CID 171817518
6-(difluoromethyl)-2-fluoro-4-methyl-3-(trifluoromethyl)pyridine
CID 133105561
2-(difluoromethyl)-6-methylpyridine
CID 54772274
2,6-bis(difluoromethyl)pyridine
CID 68586040
2-fluoro-6-methoxy-3-methylpyridine
CID 90735299
2-fluoro-3-methyl-6-(trifluoromethyl)pyridine
CID 130253491
2-(difluoromethyl)-3,6-difluoro-5-methylpyridine
CID 130099696
6-(difluoromethyl)-N-(5-fluoro-2-methylphenyl)-2-methylpyrimidin-4-amine
CID 154882766
2,3-bis(difluoromethyl)-1,4-dimethylbenzene
CID 59795341
2-(difluoromethyl)-3,6-dimethylpyridine
CID 121232017

Frequently Asked Questions

What is the IUPAC name of 6-(difluoromethyl)-2-fluoro-3-methylpyridine?
The IUPAC name of 6-(difluoromethyl)-2-fluoro-3-methylpyridine (CID 130096225) is 6-(difluoromethyl)-2-fluoro-3-methylpyridine.
What is the SMILES notation for 6-(difluoromethyl)-2-fluoro-3-methylpyridine?
The canonical SMILES for 6-(difluoromethyl)-2-fluoro-3-methylpyridine is Cc1ccc(C(F)F)nc1F.
What is the InChIKey of 6-(difluoromethyl)-2-fluoro-3-methylpyridine?
The InChIKey is SRWORLXEJZCKMK-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H6F3N/c1-4-2-3-5(6(8)9)11-7(4)10/h2-3,6H,1H3.
What are the key properties of 6-(difluoromethyl)-2-fluoro-3-methylpyridine?
6-(difluoromethyl)-2-fluoro-3-methylpyridine has a molecular weight of 161.13 g/mol, XLogP of 2.47, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(difluoromethyl)-2-fluoro-3-methylpyridine is sourced from PubChem (CID 130096225), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).