6-(difluoromethyl)-3-fluoro-5-(trifluoromethyl)pyridine-2-carbonitrile

C8H2F6N2 — CID 134685020

IUPAC6-(difluoromethyl)-3-fluoro-5-(trifluoromethyl)pyridine-2-carbonitrile
SMILESN#Cc1nc(C(F)F)c(C(F)(F)F)cc1F
InChIInChI=1S/C8H2F6N2/c9-4-1-3(8(12,13)14)6(7(10)11)16-5(4)2-15/h1,7H
InChIKeyCWPLACAJJHBFDZ-UHFFFAOYSA-N
MW240.11 g/mol
LogP3.05
Rot. Bonds1

About 6-(difluoromethyl)-3-fluoro-5-(trifluoromethyl)pyridine-2-carbonitrile

6-(difluoromethyl)-3-fluoro-5-(trifluoromethyl)pyridine-2-carbonitrile (PubChem CID 134685020) has the molecular formula C8H2F6N2 and a molecular weight of 240.11 g/mol. Its IUPAC name is 6-(difluoromethyl)-3-fluoro-5-(trifluoromethyl)pyridine-2-carbonitrile.

Molecular Properties

Compound Name6-(difluoromethyl)-3-fluoro-5-(trifluoromethyl)pyridine-2-carbonitrile
PubChem CID134685020
Molecular FormulaC8H2F6N2
Molecular Weight240.11 g/mol
Exact Mass240.01
IUPAC Name6-(difluoromethyl)-3-fluoro-5-(trifluoromethyl)pyridine-2-carbonitrile
SMILESN#Cc1nc(C(F)F)c(C(F)(F)F)cc1F
InChIInChI=1S/C8H2F6N2/c9-4-1-3(8(12,13)14)6(7(10)11)16-5(4)2-15/h1,7H
InChIKeyCWPLACAJJHBFDZ-UHFFFAOYSA-N
XLogP3.05
TPSA36.68 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.11
LogP ≤ 53.05
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

6-(difluoromethyl)-3,5-difluoropyridine-2-carbonitrile
CID 119013699
6-(difluoromethyl)-3-iodo-5-(trifluoromethyl)pyridine-2-carbonitrile
CID 130077423
3-(bromomethyl)-6-(difluoromethyl)-5-(trifluoromethyl)pyridine-2-carbonitrile
CID 133106766
5-(difluoromethyl)-6-fluoro-3-(trifluoromethyl)pyridine-2-carbonitrile
CID 134675768
3-bromo-6-(difluoromethyl)-5-fluoropyridine-2-carbonitrile
CID 130108569
6-(difluoromethyl)-3-fluoro-5-(trifluoromethyl)pyridine-2-carbaldehyde
CID 130082465
3-(difluoromethyl)-6-formyl-5-(trifluoromethyl)pyridine-2-carbonitrile
CID 118990957
6-bromo-2-(difluoromethyl)-5-(trifluoromethyl)pyridine-3-carbonitrile
CID 119017989
6-(difluoromethyl)-2-fluoro-5-(trifluoromethyl)pyridin-3-ol
CID 133106260
3-bromo-6-(difluoromethyl)-5-iodopyridine-2-carbonitrile
CID 130108635
2-(difluoromethyl)-6-formyl-5-(trifluoromethyl)pyridine-3-carbonitrile
CID 133106404
2-[6-(difluoromethyl)-5-fluoro-4-(trifluoromethyl)-2-pyridinyl]acetonitrile
CID 118820361

Frequently Asked Questions

What is the IUPAC name of 6-(difluoromethyl)-3-fluoro-5-(trifluoromethyl)pyridine-2-carbonitrile?
The IUPAC name of 6-(difluoromethyl)-3-fluoro-5-(trifluoromethyl)pyridine-2-carbonitrile (CID 134685020) is 6-(difluoromethyl)-3-fluoro-5-(trifluoromethyl)pyridine-2-carbonitrile.
What is the SMILES notation for 6-(difluoromethyl)-3-fluoro-5-(trifluoromethyl)pyridine-2-carbonitrile?
The canonical SMILES for 6-(difluoromethyl)-3-fluoro-5-(trifluoromethyl)pyridine-2-carbonitrile is N#Cc1nc(C(F)F)c(C(F)(F)F)cc1F.
What is the InChIKey of 6-(difluoromethyl)-3-fluoro-5-(trifluoromethyl)pyridine-2-carbonitrile?
The InChIKey is CWPLACAJJHBFDZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H2F6N2/c9-4-1-3(8(12,13)14)6(7(10)11)16-5(4)2-15/h1,7H.
What are the key properties of 6-(difluoromethyl)-3-fluoro-5-(trifluoromethyl)pyridine-2-carbonitrile?
6-(difluoromethyl)-3-fluoro-5-(trifluoromethyl)pyridine-2-carbonitrile has a molecular weight of 240.11 g/mol, XLogP of 3.05, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(difluoromethyl)-3-fluoro-5-(trifluoromethyl)pyridine-2-carbonitrile is sourced from PubChem (CID 134685020), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).