2-(2,3-difluorophenyl)-1-pyrazin-2-ylethanone

C12H8F2N2O — CID 62621724

IUPAC2-(2,3-difluorophenyl)-1-pyrazin-2-ylethanone
SMILESO=C(Cc1cccc(F)c1F)c1cnccn1
InChIInChI=1S/C12H8F2N2O/c13-9-3-1-2-8(12(9)14)6-11(17)10-7-15-4-5-16-10/h1-5,7H,6H2
InChIKeyQDZFAVJOAACVON-UHFFFAOYSA-N
MW234.21 g/mol
LogP2.18
Rot. Bonds3

About 2-(2,3-difluorophenyl)-1-pyrazin-2-ylethanone

2-(2,3-difluorophenyl)-1-pyrazin-2-ylethanone (PubChem CID 62621724) has the molecular formula C12H8F2N2O and a molecular weight of 234.21 g/mol. Its IUPAC name is 2-(2,3-difluorophenyl)-1-pyrazin-2-ylethanone.

Molecular Properties

Compound Name2-(2,3-difluorophenyl)-1-pyrazin-2-ylethanone
PubChem CID62621724
Molecular FormulaC12H8F2N2O
Molecular Weight234.21 g/mol
Exact Mass234.06
IUPAC Name2-(2,3-difluorophenyl)-1-pyrazin-2-ylethanone
SMILESO=C(Cc1cccc(F)c1F)c1cnccn1
InChIInChI=1S/C12H8F2N2O/c13-9-3-1-2-8(12(9)14)6-11(17)10-7-15-4-5-16-10/h1-5,7H,6H2
InChIKeyQDZFAVJOAACVON-UHFFFAOYSA-N
XLogP2.18
TPSA42.85 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.21
LogP ≤ 52.18
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2-(2,3-difluorophenyl)-1-(5-methylpyrazin-2-yl)ethanone
CID 105091145
2-(2,3-dichlorophenyl)-1-pyrazin-2-ylethanone
CID 107307824
(2,3-difluorophenyl)-pyrazin-2-ylmethanone
CID 63987968
2-(2-chlorophenyl)-1-pyrazin-2-ylethanone
CID 60799259
2-(2,3-difluorophenyl)-1-(2,6-difluorophenyl)ethanone
CID 79522311
2-(2,3-difluorophenyl)-1-quinolin-8-ylethanone
CID 115790827
2-(2,3-difluorophenyl)acetic acid;hydrochloride
CID 172702403
1-(2,3-difluorophenyl)-3-pyridin-4-ylpropan-2-one
CID 62622512
2-(2-fluorophenyl)-1-(5-methylpyrazin-2-yl)ethanone
CID 105079151
2-(2,3-difluorophenyl)-1-(2H-pyrazolo[3,4-b]pyridin-3-yl)ethanone
CID 59832206
(2-chloro-6-fluorophenyl)methyl pyrazine-2-carboxylate
CID 977894
N-[2-[(2-chloro-6-fluorobenzoyl)amino]ethyl]pyrazine-2-carboxamide
CID 108542988

Frequently Asked Questions

What is the IUPAC name of 2-(2,3-difluorophenyl)-1-pyrazin-2-ylethanone?
The IUPAC name of 2-(2,3-difluorophenyl)-1-pyrazin-2-ylethanone (CID 62621724) is 2-(2,3-difluorophenyl)-1-pyrazin-2-ylethanone.
What is the SMILES notation for 2-(2,3-difluorophenyl)-1-pyrazin-2-ylethanone?
The canonical SMILES for 2-(2,3-difluorophenyl)-1-pyrazin-2-ylethanone is O=C(Cc1cccc(F)c1F)c1cnccn1.
What is the InChIKey of 2-(2,3-difluorophenyl)-1-pyrazin-2-ylethanone?
The InChIKey is QDZFAVJOAACVON-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H8F2N2O/c13-9-3-1-2-8(12(9)14)6-11(17)10-7-15-4-5-16-10/h1-5,7H,6H2.
What are the key properties of 2-(2,3-difluorophenyl)-1-pyrazin-2-ylethanone?
2-(2,3-difluorophenyl)-1-pyrazin-2-ylethanone has a molecular weight of 234.21 g/mol, XLogP of 2.18, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,3-difluorophenyl)-1-pyrazin-2-ylethanone is sourced from PubChem (CID 62621724), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).