5,6-difluoropyrazine-2-carbonitrile

C5HF2N3 — CID 175065901

IUPAC5,6-difluoropyrazine-2-carbonitrile
SMILESN#Cc1cnc(F)c(F)n1
InChIInChI=1S/C5HF2N3/c6-4-5(7)10-3(1-8)2-9-4/h2H
InChIKeyKOBUVHNCALLHDH-UHFFFAOYSA-N
MW141.08 g/mol
LogP0.63
Rot. Bonds

About 5,6-difluoropyrazine-2-carbonitrile

5,6-difluoropyrazine-2-carbonitrile (PubChem CID 175065901) has the molecular formula C5HF2N3 and a molecular weight of 141.08 g/mol. Its IUPAC name is 5,6-difluoropyrazine-2-carbonitrile.

Molecular Properties

Compound Name5,6-difluoropyrazine-2-carbonitrile
PubChem CID175065901
Molecular FormulaC5HF2N3
Molecular Weight141.08 g/mol
Exact Mass141.01
IUPAC Name5,6-difluoropyrazine-2-carbonitrile
SMILESN#Cc1cnc(F)c(F)n1
InChIInChI=1S/C5HF2N3/c6-4-5(7)10-3(1-8)2-9-4/h2H
InChIKeyKOBUVHNCALLHDH-UHFFFAOYSA-N
XLogP0.63
TPSA49.57 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500141.08
LogP ≤ 50.63
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2,3,5-trifluoropyrazine
CID 23616019
6-bromo-3-fluoropyrazine-2-carbonitrile
CID 154733386
4-amino-5,6-difluoropyridine-2-carbonitrile
CID 70497940
4-fluoropyridine-2,6-dicarbonitrile
CID 175672759
6-cyano-N-[2-(3,4-difluorophenyl)ethyl]-3-fluoropyrazine-2-carboxamide
CID 67086169
5-amino-6-[(2,4,5-trifluorophenyl)methyl]pyrazine-2-carbonitrile
CID 171526185
5-(4-fluorophenyl)pyrazine-2-carbonitrile
CID 69058774
2,3-difluoro-5-propan-2-ylpyrazine
CID 163298620
2-fluoro-5-hydroxypyridine-3-carbonitrile
CID 131189132
3,5-dichloro-2-fluoropyridine-4-carbonitrile
CID 66926931
5-fluoro-4-methylpyridine-2-carbonitrile
CID 118235335
3-(ethylamino)pyrazine-2,5-dicarbonitrile
CID 57398215

Frequently Asked Questions

What is the IUPAC name of 5,6-difluoropyrazine-2-carbonitrile?
The IUPAC name of 5,6-difluoropyrazine-2-carbonitrile (CID 175065901) is 5,6-difluoropyrazine-2-carbonitrile.
What is the SMILES notation for 5,6-difluoropyrazine-2-carbonitrile?
The canonical SMILES for 5,6-difluoropyrazine-2-carbonitrile is N#Cc1cnc(F)c(F)n1.
What is the InChIKey of 5,6-difluoropyrazine-2-carbonitrile?
The InChIKey is KOBUVHNCALLHDH-UHFFFAOYSA-N. The full InChI is InChI=1S/C5HF2N3/c6-4-5(7)10-3(1-8)2-9-4/h2H.
What are the key properties of 5,6-difluoropyrazine-2-carbonitrile?
5,6-difluoropyrazine-2-carbonitrile has a molecular weight of 141.08 g/mol, XLogP of 0.63, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5,6-difluoropyrazine-2-carbonitrile is sourced from PubChem (CID 175065901), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).