6-acetamidopyrazine-2-carboxamide

C7H8N4O2 — CID 119095151

IUPAC6-acetamidopyrazine-2-carboxamide
SMILESCC(=O)Nc1cncc(C(N)=O)n1
InChIInChI=1S/C7H8N4O2/c1-4(12)10-6-3-9-2-5(11-6)7(8)13/h2-3H,1H3,(H2,8,13)(H,10,11,12)
InChIKeyYNUZHRSVBXYQQW-UHFFFAOYSA-N
MW180.17 g/mol
LogP-0.47
Rot. Bonds2

About 6-acetamidopyrazine-2-carboxamide

6-acetamidopyrazine-2-carboxamide (PubChem CID 119095151) has the molecular formula C7H8N4O2 and a molecular weight of 180.17 g/mol. Its IUPAC name is 6-acetamidopyrazine-2-carboxamide.

Molecular Properties

Compound Name6-acetamidopyrazine-2-carboxamide
PubChem CID119095151
Molecular FormulaC7H8N4O2
Molecular Weight180.17 g/mol
Exact Mass180.06
IUPAC Name6-acetamidopyrazine-2-carboxamide
SMILESCC(=O)Nc1cncc(C(N)=O)n1
InChIInChI=1S/C7H8N4O2/c1-4(12)10-6-3-9-2-5(11-6)7(8)13/h2-3H,1H3,(H2,8,13)(H,10,11,12)
InChIKeyYNUZHRSVBXYQQW-UHFFFAOYSA-N
XLogP-0.47
TPSA97.97 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500180.17
LogP ≤ 5-0.47
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-acetamidopyrazine-2-carboxamide?
The IUPAC name of 6-acetamidopyrazine-2-carboxamide (CID 119095151) is 6-acetamidopyrazine-2-carboxamide.
What is the SMILES notation for 6-acetamidopyrazine-2-carboxamide?
The canonical SMILES for 6-acetamidopyrazine-2-carboxamide is CC(=O)Nc1cncc(C(N)=O)n1.
What is the InChIKey of 6-acetamidopyrazine-2-carboxamide?
The InChIKey is YNUZHRSVBXYQQW-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H8N4O2/c1-4(12)10-6-3-9-2-5(11-6)7(8)13/h2-3H,1H3,(H2,8,13)(H,10,11,12).
What are the key properties of 6-acetamidopyrazine-2-carboxamide?
6-acetamidopyrazine-2-carboxamide has a molecular weight of 180.17 g/mol, XLogP of -0.47, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-acetamidopyrazine-2-carboxamide is sourced from PubChem (CID 119095151), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).