2-pyrazin-2-yl-1-pyridin-2-ylethanone

C11H9N3O — CID 3739313

IUPAC2-pyrazin-2-yl-1-pyridin-2-ylethanone
SMILESO=C(Cc1cnccn1)c1ccccn1
InChIInChI=1S/C11H9N3O/c15-11(10-3-1-2-4-14-10)7-9-8-12-5-6-13-9/h1-6,8H,7H2
InChIKeyYVFNIFPOLTXCNN-UHFFFAOYSA-N
MW199.21 g/mol
LogP1.30
Rot. Bonds3

About 2-pyrazin-2-yl-1-pyridin-2-ylethanone

2-pyrazin-2-yl-1-pyridin-2-ylethanone (PubChem CID 3739313) has the molecular formula C11H9N3O and a molecular weight of 199.21 g/mol. Its IUPAC name is 2-pyrazin-2-yl-1-pyridin-2-ylethanone.

Molecular Properties

Compound Name2-pyrazin-2-yl-1-pyridin-2-ylethanone
PubChem CID3739313
Molecular FormulaC11H9N3O
Molecular Weight199.21 g/mol
Exact Mass199.07
IUPAC Name2-pyrazin-2-yl-1-pyridin-2-ylethanone
SMILESO=C(Cc1cnccn1)c1ccccn1
InChIInChI=1S/C11H9N3O/c15-11(10-3-1-2-4-14-10)7-9-8-12-5-6-13-9/h1-6,8H,7H2
InChIKeyYVFNIFPOLTXCNN-UHFFFAOYSA-N
XLogP1.30
TPSA55.74 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.21
LogP ≤ 51.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

pyrazin-2-yl(pyridin-2-yl)methanone
CID 22931525
1,4-di(pyrazin-2-yl)butane-2,3-dione
CID 57316761
2-pyrazin-2-ylacetic acid
CID 19797048
1-(1-benzofuran-3-yl)-2-pyrazin-2-ylethanone
CID 116832768
2-(2-chlorophenyl)-1-pyrazin-2-ylethanone
CID 60799259
3-amino-1-pyridin-2-ylpropan-1-one
CID 45079500
1-(2-methyl-1H-indol-3-yl)-2-pyrazin-2-ylethanone
CID 116832726
2-(1-propan-2-ylpyrazol-3-yl)-1-pyrazin-2-ylethanone
CID 64770824
1-(4-methylsulfanylphenyl)-2-pyrazin-2-ylethanone
CID 116832739
5-(2-pyrazin-2-ylacetyl)-1,3-dihydrobenzimidazol-2-one
CID 116832745
1-pyridin-2-ylbutane-1,3-dione
CID 12707221
3-oxo-3-pyridin-2-ylpropanal
CID 22486385

Frequently Asked Questions

What is the IUPAC name of 2-pyrazin-2-yl-1-pyridin-2-ylethanone?
The IUPAC name of 2-pyrazin-2-yl-1-pyridin-2-ylethanone (CID 3739313) is 2-pyrazin-2-yl-1-pyridin-2-ylethanone.
What is the SMILES notation for 2-pyrazin-2-yl-1-pyridin-2-ylethanone?
The canonical SMILES for 2-pyrazin-2-yl-1-pyridin-2-ylethanone is O=C(Cc1cnccn1)c1ccccn1.
What is the InChIKey of 2-pyrazin-2-yl-1-pyridin-2-ylethanone?
The InChIKey is YVFNIFPOLTXCNN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H9N3O/c15-11(10-3-1-2-4-14-10)7-9-8-12-5-6-13-9/h1-6,8H,7H2.
What are the key properties of 2-pyrazin-2-yl-1-pyridin-2-ylethanone?
2-pyrazin-2-yl-1-pyridin-2-ylethanone has a molecular weight of 199.21 g/mol, XLogP of 1.30, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-pyrazin-2-yl-1-pyridin-2-ylethanone is sourced from PubChem (CID 3739313), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).