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

C8H4F5N3 — CID 119014969

IUPAC6-amino-5-(difluoromethyl)-2-(trifluoromethyl)pyridine-3-carbonitrile
SMILESN#Cc1cc(C(F)F)c(N)nc1C(F)(F)F
InChIInChI=1S/C8H4F5N3/c9-6(10)4-1-3(2-14)5(8(11,12)13)16-7(4)15/h1,6H,(H2,15,16)
InChIKeyLMEWEYHKIPHCSA-UHFFFAOYSA-N
MW237.13 g/mol
LogP2.49
Rot. Bonds1

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

6-amino-5-(difluoromethyl)-2-(trifluoromethyl)pyridine-3-carbonitrile (PubChem CID 119014969) has the molecular formula C8H4F5N3 and a molecular weight of 237.13 g/mol. Its IUPAC name is 6-amino-5-(difluoromethyl)-2-(trifluoromethyl)pyridine-3-carbonitrile.

Molecular Properties

Compound Name6-amino-5-(difluoromethyl)-2-(trifluoromethyl)pyridine-3-carbonitrile
PubChem CID119014969
Molecular FormulaC8H4F5N3
Molecular Weight237.13 g/mol
Exact Mass237.03
IUPAC Name6-amino-5-(difluoromethyl)-2-(trifluoromethyl)pyridine-3-carbonitrile
SMILESN#Cc1cc(C(F)F)c(N)nc1C(F)(F)F
InChIInChI=1S/C8H4F5N3/c9-6(10)4-1-3(2-14)5(8(11,12)13)16-7(4)15/h1,6H,(H2,15,16)
InChIKeyLMEWEYHKIPHCSA-UHFFFAOYSA-N
XLogP2.49
TPSA62.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.13
LogP ≤ 52.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-(difluoromethyl)-5-methyl-6-(trifluoromethyl)pyridin-2-amine
CID 119019045
6-amino-5-(difluoromethyl)-2-(trifluoromethyl)pyridin-3-ol
CID 119021073
5-bromo-3-(difluoromethyl)-6-(trifluoromethyl)pyridin-2-amine
CID 118999839
6-amino-5-(difluoromethyl)-2-formylpyridine-3-carbonitrile
CID 119001249
3-(difluoromethyl)-5-methoxy-6-(trifluoromethyl)pyridin-2-amine
CID 119019307
5-(difluoromethyl)-3-fluoro-6-(trifluoromethyl)pyridin-2-amine
CID 118999361
5-cyano-2-(difluoromethyl)-6-(trifluoromethyl)pyridine-3-carboxylic acid
CID 133106197
6-(difluoromethyl)-5-nitro-2-(trifluoromethyl)pyridine-3-carbonitrile
CID 134675519
5-(difluoromethyl)-6-(trifluoromethyl)pyridine-3-carbonitrile
CID 134671200
6-amino-5-(difluoromethyl)pyridine-3-carbonitrile
CID 130094585
6-bromo-3-(difluoromethyl)-2-(trifluoromethyl)pyridine-4-carbonitrile
CID 130108881
3-(difluoromethyl)-5-hydroxy-6-(trifluoromethyl)pyridine-2-carbonitrile
CID 119020295

Frequently Asked Questions

What is the IUPAC name of 6-amino-5-(difluoromethyl)-2-(trifluoromethyl)pyridine-3-carbonitrile?
The IUPAC name of 6-amino-5-(difluoromethyl)-2-(trifluoromethyl)pyridine-3-carbonitrile (CID 119014969) is 6-amino-5-(difluoromethyl)-2-(trifluoromethyl)pyridine-3-carbonitrile.
What is the SMILES notation for 6-amino-5-(difluoromethyl)-2-(trifluoromethyl)pyridine-3-carbonitrile?
The canonical SMILES for 6-amino-5-(difluoromethyl)-2-(trifluoromethyl)pyridine-3-carbonitrile is N#Cc1cc(C(F)F)c(N)nc1C(F)(F)F.
What is the InChIKey of 6-amino-5-(difluoromethyl)-2-(trifluoromethyl)pyridine-3-carbonitrile?
The InChIKey is LMEWEYHKIPHCSA-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H4F5N3/c9-6(10)4-1-3(2-14)5(8(11,12)13)16-7(4)15/h1,6H,(H2,15,16).
What are the key properties of 6-amino-5-(difluoromethyl)-2-(trifluoromethyl)pyridine-3-carbonitrile?
6-amino-5-(difluoromethyl)-2-(trifluoromethyl)pyridine-3-carbonitrile has a molecular weight of 237.13 g/mol, XLogP of 2.49, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-amino-5-(difluoromethyl)-2-(trifluoromethyl)pyridine-3-carbonitrile is sourced from PubChem (CID 119014969), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).