(2-methylpyrimidin-4-yl)-pyrazin-2-ylmethanone

C10H8N4O — CID 115529870

IUPAC(2-methylpyrimidin-4-yl)-pyrazin-2-ylmethanone
SMILESCc1nccc(C(=O)c2cnccn2)n1
InChIInChI=1S/C10H8N4O/c1-7-12-3-2-8(14-7)10(15)9-6-11-4-5-13-9/h2-6H,1H3
InChIKeyZJVCNVVFYUUPKY-UHFFFAOYSA-N
MW200.20 g/mol
LogP0.81
Rot. Bonds2

About (2-methylpyrimidin-4-yl)-pyrazin-2-ylmethanone

(2-methylpyrimidin-4-yl)-pyrazin-2-ylmethanone (PubChem CID 115529870) has the molecular formula C10H8N4O and a molecular weight of 200.20 g/mol. Its IUPAC name is (2-methylpyrimidin-4-yl)-pyrazin-2-ylmethanone.

Molecular Properties

Compound Name(2-methylpyrimidin-4-yl)-pyrazin-2-ylmethanone
PubChem CID115529870
Molecular FormulaC10H8N4O
Molecular Weight200.20 g/mol
Exact Mass200.07
IUPAC Name(2-methylpyrimidin-4-yl)-pyrazin-2-ylmethanone
SMILESCc1nccc(C(=O)c2cnccn2)n1
InChIInChI=1S/C10H8N4O/c1-7-12-3-2-8(14-7)10(15)9-6-11-4-5-13-9/h2-6H,1H3
InChIKeyZJVCNVVFYUUPKY-UHFFFAOYSA-N
XLogP0.81
TPSA68.63 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.20
LogP ≤ 50.81
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

pyrazin-2-yl(pyridin-2-yl)methanone
CID 22931525
2,2-dimethyl-1-(2-methylpyrimidin-4-yl)propan-1-one
CID 115529797
2-methyl-1-(2-methylpyrimidin-4-yl)propan-1-one
CID 23333319
2-bromo-1-(2-methylpyrimidin-4-yl)ethanone
CID 130867076
(2,6-difluoro-3-methylphenyl)-pyrazin-2-ylmethanone
CID 82820337
(2-chloro-4-methylphenyl)-pyrazin-2-ylmethanone
CID 106864959
(3-fluorophenyl)-(2-methylpyrimidin-4-yl)methanone
CID 115529848
1-(2-methylpyrimidin-4-yl)butan-1-one
CID 23333315
[(2S)-2-(2-methylpyrimidin-4-yl)morpholin-4-yl]-pyrazin-2-ylmethanone
CID 95845102
(5-amino-6-bromopyrazin-2-yl)-pyrazin-2-ylmethanone
CID 129057388
(3-ethyl-6-methylpyridazin-4-yl)-pyrazin-2-ylmethanone
CID 105101394
[2-methyl-4-(trifluoromethyl)phenyl]-pyrazin-2-ylmethanone
CID 102752335

Frequently Asked Questions

What is the IUPAC name of (2-methylpyrimidin-4-yl)-pyrazin-2-ylmethanone?
The IUPAC name of (2-methylpyrimidin-4-yl)-pyrazin-2-ylmethanone (CID 115529870) is (2-methylpyrimidin-4-yl)-pyrazin-2-ylmethanone.
What is the SMILES notation for (2-methylpyrimidin-4-yl)-pyrazin-2-ylmethanone?
The canonical SMILES for (2-methylpyrimidin-4-yl)-pyrazin-2-ylmethanone is Cc1nccc(C(=O)c2cnccn2)n1.
What is the InChIKey of (2-methylpyrimidin-4-yl)-pyrazin-2-ylmethanone?
The InChIKey is ZJVCNVVFYUUPKY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8N4O/c1-7-12-3-2-8(14-7)10(15)9-6-11-4-5-13-9/h2-6H,1H3.
What are the key properties of (2-methylpyrimidin-4-yl)-pyrazin-2-ylmethanone?
(2-methylpyrimidin-4-yl)-pyrazin-2-ylmethanone has a molecular weight of 200.20 g/mol, XLogP of 0.81, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (2-methylpyrimidin-4-yl)-pyrazin-2-ylmethanone is sourced from PubChem (CID 115529870), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).