2-amino-6-(difluoromethyl)pyridine-4-carbonitrile

C7H5F2N3 — CID 119013470

IUPAC2-amino-6-(difluoromethyl)pyridine-4-carbonitrile
SMILESN#Cc1cc(N)nc(C(F)F)c1
InChIInChI=1S/C7H5F2N3/c8-7(9)5-1-4(3-10)2-6(11)12-5/h1-2,7H,(H2,11,12)
InChIKeyXNZNYRPUECTIKQ-UHFFFAOYSA-N
MW169.13 g/mol
LogP1.47
Rot. Bonds1

About 2-amino-6-(difluoromethyl)pyridine-4-carbonitrile

2-amino-6-(difluoromethyl)pyridine-4-carbonitrile (PubChem CID 119013470) has the molecular formula C7H5F2N3 and a molecular weight of 169.13 g/mol. Its IUPAC name is 2-amino-6-(difluoromethyl)pyridine-4-carbonitrile.

Molecular Properties

Compound Name2-amino-6-(difluoromethyl)pyridine-4-carbonitrile
PubChem CID119013470
Molecular FormulaC7H5F2N3
Molecular Weight169.13 g/mol
Exact Mass169.05
IUPAC Name2-amino-6-(difluoromethyl)pyridine-4-carbonitrile
SMILESN#Cc1cc(N)nc(C(F)F)c1
InChIInChI=1S/C7H5F2N3/c8-7(9)5-1-4(3-10)2-6(11)12-5/h1-2,7H,(H2,11,12)
InChIKeyXNZNYRPUECTIKQ-UHFFFAOYSA-N
XLogP1.47
TPSA62.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.13
LogP ≤ 51.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2,6-diaminopyridine-4-carbonitrile
CID 55284821
2-(difluoromethyl)pyridine-4-carbonitrile
CID 75406284
2-amino-6-(difluoromethyl)-4-methylpyridine-3-carbonitrile
CID 130103307
6-amino-2-(difluoromethyl)-3-hydroxypyridine-4-carbonitrile
CID 130103207
6-amino-3-bromo-2-(difluoromethyl)pyridine-4-carbonitrile
CID 130101612
4-amino-3-cyano-6-(difluoromethyl)pyridine-2-carboxylic acid
CID 118829125
2-amino-6-(difluoromethyl)-4-(trifluoromethoxy)pyridine-3-carbonitrile
CID 119001123
6-amino-5-(difluoromethyl)pyridine-3-carbonitrile
CID 130094585
2-(aminomethyl)-6-(difluoromethyl)-4-fluoropyridine-3-carbonitrile
CID 118836753
6-(difluoromethyl)-4-fluoro-3-iodopyridine-2-carbonitrile
CID 130075909
2-chloro-6-(difluoromethyl)-4-fluoropyridine-3-carbonitrile
CID 119004602
3-bromo-4-chloro-6-(difluoromethyl)pyridine-2-carbonitrile
CID 130107774

Frequently Asked Questions

What is the IUPAC name of 2-amino-6-(difluoromethyl)pyridine-4-carbonitrile?
The IUPAC name of 2-amino-6-(difluoromethyl)pyridine-4-carbonitrile (CID 119013470) is 2-amino-6-(difluoromethyl)pyridine-4-carbonitrile.
What is the SMILES notation for 2-amino-6-(difluoromethyl)pyridine-4-carbonitrile?
The canonical SMILES for 2-amino-6-(difluoromethyl)pyridine-4-carbonitrile is N#Cc1cc(N)nc(C(F)F)c1.
What is the InChIKey of 2-amino-6-(difluoromethyl)pyridine-4-carbonitrile?
The InChIKey is XNZNYRPUECTIKQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H5F2N3/c8-7(9)5-1-4(3-10)2-6(11)12-5/h1-2,7H,(H2,11,12).
What are the key properties of 2-amino-6-(difluoromethyl)pyridine-4-carbonitrile?
2-amino-6-(difluoromethyl)pyridine-4-carbonitrile has a molecular weight of 169.13 g/mol, XLogP of 1.47, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-6-(difluoromethyl)pyridine-4-carbonitrile is sourced from PubChem (CID 119013470), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).