2-amino-6-cyano-3-(difluoromethyl)pyridine-4-carboxamide

C8H6F2N4O — CID 118995384

IUPAC2-amino-6-cyano-3-(difluoromethyl)pyridine-4-carboxamide
SMILESN#Cc1cc(C(N)=O)c(C(F)F)c(N)n1
InChIInChI=1S/C8H6F2N4O/c9-6(10)5-4(8(13)15)1-3(2-11)14-7(5)12/h1,6H,(H2,12,14)(H2,13,15)
InChIKeyKRBLBPPRFRUDFR-UHFFFAOYSA-N
MW212.16 g/mol
LogP0.57
Rot. Bonds2

About 2-amino-6-cyano-3-(difluoromethyl)pyridine-4-carboxamide

2-amino-6-cyano-3-(difluoromethyl)pyridine-4-carboxamide (PubChem CID 118995384) has the molecular formula C8H6F2N4O and a molecular weight of 212.16 g/mol. Its IUPAC name is 2-amino-6-cyano-3-(difluoromethyl)pyridine-4-carboxamide.

Molecular Properties

Compound Name2-amino-6-cyano-3-(difluoromethyl)pyridine-4-carboxamide
PubChem CID118995384
Molecular FormulaC8H6F2N4O
Molecular Weight212.16 g/mol
Exact Mass212.05
IUPAC Name2-amino-6-cyano-3-(difluoromethyl)pyridine-4-carboxamide
SMILESN#Cc1cc(C(N)=O)c(C(F)F)c(N)n1
InChIInChI=1S/C8H6F2N4O/c9-6(10)5-4(8(13)15)1-3(2-11)14-7(5)12/h1,6H,(H2,12,14)(H2,13,15)
InChIKeyKRBLBPPRFRUDFR-UHFFFAOYSA-N
XLogP0.57
TPSA105.79 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.16
LogP ≤ 50.57
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-amino-3-(difluoromethyl)-6-fluoropyridine-4-carboxamide
CID 118998716
4,6-diamino-5-(difluoromethyl)pyridine-2-carbonitrile
CID 130098584
6-amino-4-(bromomethyl)-5-(difluoromethyl)pyridine-2-carbonitrile
CID 119015380
6-cyano-2-(difluoromethyl)pyridine-3-carboxamide
CID 130096117
methyl 2-amino-6-cyano-4-(difluoromethyl)pyridine-3-carboxylate
CID 130103649
6-cyano-2-(difluoromethyl)-3-hydroxypyridine-4-carboxylic acid
CID 130076877
methyl 6-cyano-3-(difluoromethyl)-2-(trifluoromethyl)pyridine-4-carboxylate
CID 133106205
6-cyano-5-(difluoromethyl)-4-fluoropyridine-2-carboxamide
CID 118992430
3-chloro-6-cyano-2-(difluoromethyl)pyridine-4-carbonyl chloride
CID 134674147
2-amino-3-(difluoromethyl)-6-methylpyridine-4-carboxylic acid
CID 119006118
2-chloro-3-cyano-6-(difluoromethyl)pyridine-4-carboxamide
CID 119016503
4-amino-6-cyano-3-(difluoromethyl)pyridine-2-sulfonyl chloride
CID 118851281

Frequently Asked Questions

What is the IUPAC name of 2-amino-6-cyano-3-(difluoromethyl)pyridine-4-carboxamide?
The IUPAC name of 2-amino-6-cyano-3-(difluoromethyl)pyridine-4-carboxamide (CID 118995384) is 2-amino-6-cyano-3-(difluoromethyl)pyridine-4-carboxamide.
What is the SMILES notation for 2-amino-6-cyano-3-(difluoromethyl)pyridine-4-carboxamide?
The canonical SMILES for 2-amino-6-cyano-3-(difluoromethyl)pyridine-4-carboxamide is N#Cc1cc(C(N)=O)c(C(F)F)c(N)n1.
What is the InChIKey of 2-amino-6-cyano-3-(difluoromethyl)pyridine-4-carboxamide?
The InChIKey is KRBLBPPRFRUDFR-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H6F2N4O/c9-6(10)5-4(8(13)15)1-3(2-11)14-7(5)12/h1,6H,(H2,12,14)(H2,13,15).
What are the key properties of 2-amino-6-cyano-3-(difluoromethyl)pyridine-4-carboxamide?
2-amino-6-cyano-3-(difluoromethyl)pyridine-4-carboxamide has a molecular weight of 212.16 g/mol, XLogP of 0.57, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-6-cyano-3-(difluoromethyl)pyridine-4-carboxamide is sourced from PubChem (CID 118995384), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).