3-methyl-6-oxo-2,3-dihydro-1H-pyrazine-5-carboxamide

C6H9N3O2 — CID 123706108

IUPAC3-methyl-6-oxo-2,3-dihydro-1H-pyrazine-5-carboxamide
SMILESCC1CNC(=O)C(C(N)=O)=N1
InChIInChI=1S/C6H9N3O2/c1-3-2-8-6(11)4(9-3)5(7)10/h3H,2H2,1H3,(H2,7,10)(H,8,11)
InChIKeyIKDRQUNAURXTIK-UHFFFAOYSA-N
MW155.16 g/mol
LogP-1.57
Rot. Bonds1

About 3-methyl-6-oxo-2,3-dihydro-1H-pyrazine-5-carboxamide

3-methyl-6-oxo-2,3-dihydro-1H-pyrazine-5-carboxamide (PubChem CID 123706108) has the molecular formula C6H9N3O2 and a molecular weight of 155.16 g/mol. Its IUPAC name is 3-methyl-6-oxo-2,3-dihydro-1H-pyrazine-5-carboxamide.

Molecular Properties

Compound Name3-methyl-6-oxo-2,3-dihydro-1H-pyrazine-5-carboxamide
PubChem CID123706108
Molecular FormulaC6H9N3O2
Molecular Weight155.16 g/mol
Exact Mass155.07
IUPAC Name3-methyl-6-oxo-2,3-dihydro-1H-pyrazine-5-carboxamide
SMILESCC1CNC(=O)C(C(N)=O)=N1
InChIInChI=1S/C6H9N3O2/c1-3-2-8-6(11)4(9-3)5(7)10/h3H,2H2,1H3,(H2,7,10)(H,8,11)
InChIKeyIKDRQUNAURXTIK-UHFFFAOYSA-N
XLogP-1.57
TPSA84.55 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500155.16
LogP ≤ 5-1.57
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

(5S)-3-amino-5-methyl-2,5-dihydro-1H-pyrazin-6-one
CID 45092769
2,4-dimethyl-4,5-dihydro-1H-imidazole
CID 135915972
(3S,4S)-4-ethyl-5-oxopyrrolidine-3-carboxylic acid
CID 131851987
4-(2-methyl-3-oxopiperazin-1-yl)sulfonylbenzamide
CID 63606240
5-hydroxy-3,4-dimethyl-2,3-dihydro-1H-pyridin-6-one
CID 142451048
4-(4-methyl-6-oxo-4,5-dihydro-1H-pyridazin-3-yl)benzamide
CID 14623690
ethyl (7S)-7-methyl-4-oxo-6,7-dihydro-5H-pyrazolo[1,5-a]pyrazine-3-carboxylate
CID 118700955
4-methyl-3-methylidenepyrrolidin-2-one
CID 69168911
(3S)-3-[(1S)-1-hydroxyethyl]-4-methylpyrrolidin-2-one
CID 55299112
(3R,4R)-4-amino-5-oxopyrrolidine-3-carboxylic acid;hydrochloride
CID 171921039
carbonic acid;5-methyl-4,5-dihydro-1H-imidazol-2-amine
CID 159919464
3-methyl-5-oxoimidazolidine-4-carboxamide
CID 45084197

Frequently Asked Questions

What is the IUPAC name of 3-methyl-6-oxo-2,3-dihydro-1H-pyrazine-5-carboxamide?
The IUPAC name of 3-methyl-6-oxo-2,3-dihydro-1H-pyrazine-5-carboxamide (CID 123706108) is 3-methyl-6-oxo-2,3-dihydro-1H-pyrazine-5-carboxamide.
What is the SMILES notation for 3-methyl-6-oxo-2,3-dihydro-1H-pyrazine-5-carboxamide?
The canonical SMILES for 3-methyl-6-oxo-2,3-dihydro-1H-pyrazine-5-carboxamide is CC1CNC(=O)C(C(N)=O)=N1.
What is the InChIKey of 3-methyl-6-oxo-2,3-dihydro-1H-pyrazine-5-carboxamide?
The InChIKey is IKDRQUNAURXTIK-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H9N3O2/c1-3-2-8-6(11)4(9-3)5(7)10/h3H,2H2,1H3,(H2,7,10)(H,8,11).
What are the key properties of 3-methyl-6-oxo-2,3-dihydro-1H-pyrazine-5-carboxamide?
3-methyl-6-oxo-2,3-dihydro-1H-pyrazine-5-carboxamide has a molecular weight of 155.16 g/mol, XLogP of -1.57, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-6-oxo-2,3-dihydro-1H-pyrazine-5-carboxamide is sourced from PubChem (CID 123706108), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).