N,4-dimethyl-5-oxopyrazine-2-carboxamide

C7H9N3O2 — CID 89276713

IUPACN,4-dimethyl-5-oxopyrazine-2-carboxamide
SMILESCNC(=O)c1cn(C)c(=O)cn1
InChIInChI=1S/C7H9N3O2/c1-8-7(12)5-4-10(2)6(11)3-9-5/h3-4H,1-2H3,(H,8,12)
InChIKeyDZTLZASAWDGGMX-UHFFFAOYSA-N
MW167.17 g/mol
LogP-0.86
Rot. Bonds1

About N,4-dimethyl-5-oxopyrazine-2-carboxamide

N,4-dimethyl-5-oxopyrazine-2-carboxamide (PubChem CID 89276713) has the molecular formula C7H9N3O2 and a molecular weight of 167.17 g/mol. Its IUPAC name is N,4-dimethyl-5-oxopyrazine-2-carboxamide.

Molecular Properties

Compound NameN,4-dimethyl-5-oxopyrazine-2-carboxamide
PubChem CID89276713
Molecular FormulaC7H9N3O2
Molecular Weight167.17 g/mol
Exact Mass167.07
IUPAC NameN,4-dimethyl-5-oxopyrazine-2-carboxamide
SMILESCNC(=O)c1cn(C)c(=O)cn1
InChIInChI=1S/C7H9N3O2/c1-8-7(12)5-4-10(2)6(11)3-9-5/h3-4H,1-2H3,(H,8,12)
InChIKeyDZTLZASAWDGGMX-UHFFFAOYSA-N
XLogP-0.86
TPSA63.99 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500167.17
LogP ≤ 5-0.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N,4-dimethyl-5-oxopyrazine-2-carboxamide?
The IUPAC name of N,4-dimethyl-5-oxopyrazine-2-carboxamide (CID 89276713) is N,4-dimethyl-5-oxopyrazine-2-carboxamide.
What is the SMILES notation for N,4-dimethyl-5-oxopyrazine-2-carboxamide?
The canonical SMILES for N,4-dimethyl-5-oxopyrazine-2-carboxamide is CNC(=O)c1cn(C)c(=O)cn1.
What is the InChIKey of N,4-dimethyl-5-oxopyrazine-2-carboxamide?
The InChIKey is DZTLZASAWDGGMX-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H9N3O2/c1-8-7(12)5-4-10(2)6(11)3-9-5/h3-4H,1-2H3,(H,8,12).
What are the key properties of N,4-dimethyl-5-oxopyrazine-2-carboxamide?
N,4-dimethyl-5-oxopyrazine-2-carboxamide has a molecular weight of 167.17 g/mol, XLogP of -0.86, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,4-dimethyl-5-oxopyrazine-2-carboxamide is sourced from PubChem (CID 89276713), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).