3-amino-N-methyl-6-thiophen-2-ylpyrazine-2-carboxamide

C10H10N4OS — CID 68650476

IUPAC3-amino-N-methyl-6-thiophen-2-ylpyrazine-2-carboxamide
SMILESCNC(=O)c1nc(-c2cccs2)cnc1N
InChIInChI=1S/C10H10N4OS/c1-12-10(15)8-9(11)13-5-6(14-8)7-3-2-4-16-7/h2-5H,1H3,(H2,11,13)(H,12,15)
InChIKeyTVJUXPNAQAKSRC-UHFFFAOYSA-N
MW234.28 g/mol
LogP1.15
Rot. Bonds2

About 3-amino-N-methyl-6-thiophen-2-ylpyrazine-2-carboxamide

3-amino-N-methyl-6-thiophen-2-ylpyrazine-2-carboxamide (PubChem CID 68650476) has the molecular formula C10H10N4OS and a molecular weight of 234.28 g/mol. Its IUPAC name is 3-amino-N-methyl-6-thiophen-2-ylpyrazine-2-carboxamide.

Molecular Properties

Compound Name3-amino-N-methyl-6-thiophen-2-ylpyrazine-2-carboxamide
PubChem CID68650476
Molecular FormulaC10H10N4OS
Molecular Weight234.28 g/mol
Exact Mass234.06
IUPAC Name3-amino-N-methyl-6-thiophen-2-ylpyrazine-2-carboxamide
SMILESCNC(=O)c1nc(-c2cccs2)cnc1N
InChIInChI=1S/C10H10N4OS/c1-12-10(15)8-9(11)13-5-6(14-8)7-3-2-4-16-7/h2-5H,1H3,(H2,11,13)(H,12,15)
InChIKeyTVJUXPNAQAKSRC-UHFFFAOYSA-N
XLogP1.15
TPSA80.90 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.28
LogP ≤ 51.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 3-amino-N-methyl-6-thiophen-2-ylpyrazine-2-carboxamide?
The IUPAC name of 3-amino-N-methyl-6-thiophen-2-ylpyrazine-2-carboxamide (CID 68650476) is 3-amino-N-methyl-6-thiophen-2-ylpyrazine-2-carboxamide.
What is the SMILES notation for 3-amino-N-methyl-6-thiophen-2-ylpyrazine-2-carboxamide?
The canonical SMILES for 3-amino-N-methyl-6-thiophen-2-ylpyrazine-2-carboxamide is CNC(=O)c1nc(-c2cccs2)cnc1N.
What is the InChIKey of 3-amino-N-methyl-6-thiophen-2-ylpyrazine-2-carboxamide?
The InChIKey is TVJUXPNAQAKSRC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10N4OS/c1-12-10(15)8-9(11)13-5-6(14-8)7-3-2-4-16-7/h2-5H,1H3,(H2,11,13)(H,12,15).
What are the key properties of 3-amino-N-methyl-6-thiophen-2-ylpyrazine-2-carboxamide?
3-amino-N-methyl-6-thiophen-2-ylpyrazine-2-carboxamide has a molecular weight of 234.28 g/mol, XLogP of 1.15, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-methyl-6-thiophen-2-ylpyrazine-2-carboxamide is sourced from PubChem (CID 68650476), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).