2,3-difluoro-5-propan-2-ylpyrazine

C7H8F2N2 — CID 163298620

IUPAC2,3-difluoro-5-propan-2-ylpyrazine
SMILESCC(C)c1cnc(F)c(F)n1
InChIInChI=1S/C7H8F2N2/c1-4(2)5-3-10-6(8)7(9)11-5/h3-4H,1-2H3
InChIKeyRCKXBPWFENNDDG-UHFFFAOYSA-N
MW158.15 g/mol
LogP1.88
Rot. Bonds1

About 2,3-difluoro-5-propan-2-ylpyrazine

2,3-difluoro-5-propan-2-ylpyrazine (PubChem CID 163298620) has the molecular formula C7H8F2N2 and a molecular weight of 158.15 g/mol. Its IUPAC name is 2,3-difluoro-5-propan-2-ylpyrazine.

Molecular Properties

Compound Name2,3-difluoro-5-propan-2-ylpyrazine
PubChem CID163298620
Molecular FormulaC7H8F2N2
Molecular Weight158.15 g/mol
Exact Mass158.07
IUPAC Name2,3-difluoro-5-propan-2-ylpyrazine
SMILESCC(C)c1cnc(F)c(F)n1
InChIInChI=1S/C7H8F2N2/c1-4(2)5-3-10-6(8)7(9)11-5/h3-4H,1-2H3
InChIKeyRCKXBPWFENNDDG-UHFFFAOYSA-N
XLogP1.88
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500158.15
LogP ≤ 51.88
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

3-bromo-2-fluoro-6-propan-2-ylpyridine
CID 130138752
2,3,5-trifluoropyrazine
CID 23616019
3-bromo-2-methyl-5-propan-2-ylpyrazine
CID 118329292
2,5-di(propan-2-yl)pyrazine;2,6-di(propan-2-yl)pyrazine
CID 161386893
2,3,5-tri(propan-2-yl)pyrazine
CID 58164581
4,5-difluoro-2-propan-2-ylpyridine
CID 170611007
4-bromo-2-fluoro-3-methyl-6-propan-2-ylpyridine
CID 153298968
2,4,5-trifluoro-3-propan-2-ylpyridine
CID 142438330
3-bromo-5-propan-2-yl-1,2,4-triazine
CID 105454049
3-methyl-5-propan-2-ylpyrazin-2-amine
CID 123964428
4-bromo-5-fluoro-2-propan-2-ylpyridine
CID 130153353
3-tert-butyl-5-propan-2-yl-1,2,4-triazine
CID 170117285

Frequently Asked Questions

What is the IUPAC name of 2,3-difluoro-5-propan-2-ylpyrazine?
The IUPAC name of 2,3-difluoro-5-propan-2-ylpyrazine (CID 163298620) is 2,3-difluoro-5-propan-2-ylpyrazine.
What is the SMILES notation for 2,3-difluoro-5-propan-2-ylpyrazine?
The canonical SMILES for 2,3-difluoro-5-propan-2-ylpyrazine is CC(C)c1cnc(F)c(F)n1.
What is the InChIKey of 2,3-difluoro-5-propan-2-ylpyrazine?
The InChIKey is RCKXBPWFENNDDG-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H8F2N2/c1-4(2)5-3-10-6(8)7(9)11-5/h3-4H,1-2H3.
What are the key properties of 2,3-difluoro-5-propan-2-ylpyrazine?
2,3-difluoro-5-propan-2-ylpyrazine has a molecular weight of 158.15 g/mol, XLogP of 1.88, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-difluoro-5-propan-2-ylpyrazine is sourced from PubChem (CID 163298620), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).