3-amino-N-(4-methyl-1,3-thiazol-2-yl)pyrazine-2-carboxamide

C9H9N5OS — CID 18138823

IUPAC3-amino-N-(4-methyl-1,3-thiazol-2-yl)pyrazine-2-carboxamide
SMILESCc1csc(NC(=O)c2nccnc2N)n1
InChIInChI=1S/C9H9N5OS/c1-5-4-16-9(13-5)14-8(15)6-7(10)12-3-2-11-6/h2-4H,1H3,(H2,10,12)(H,13,14,15)
InChIKeyMYGYSJAPCUOJCO-UHFFFAOYSA-N
MW235.27 g/mol
LogP1.08
Rot. Bonds2

About 3-amino-N-(4-methyl-1,3-thiazol-2-yl)pyrazine-2-carboxamide

3-amino-N-(4-methyl-1,3-thiazol-2-yl)pyrazine-2-carboxamide (PubChem CID 18138823) has the molecular formula C9H9N5OS and a molecular weight of 235.27 g/mol. Its IUPAC name is 3-amino-N-(4-methyl-1,3-thiazol-2-yl)pyrazine-2-carboxamide.

Molecular Properties

Compound Name3-amino-N-(4-methyl-1,3-thiazol-2-yl)pyrazine-2-carboxamide
PubChem CID18138823
Molecular FormulaC9H9N5OS
Molecular Weight235.27 g/mol
Exact Mass235.05
IUPAC Name3-amino-N-(4-methyl-1,3-thiazol-2-yl)pyrazine-2-carboxamide
SMILESCc1csc(NC(=O)c2nccnc2N)n1
InChIInChI=1S/C9H9N5OS/c1-5-4-16-9(13-5)14-8(15)6-7(10)12-3-2-11-6/h2-4H,1H3,(H2,10,12)(H,13,14,15)
InChIKeyMYGYSJAPCUOJCO-UHFFFAOYSA-N
XLogP1.08
TPSA93.79 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.27
LogP ≤ 51.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 3-amino-N-(4-methyl-1,3-thiazol-2-yl)pyrazine-2-carboxamide?
The IUPAC name of 3-amino-N-(4-methyl-1,3-thiazol-2-yl)pyrazine-2-carboxamide (CID 18138823) is 3-amino-N-(4-methyl-1,3-thiazol-2-yl)pyrazine-2-carboxamide.
What is the SMILES notation for 3-amino-N-(4-methyl-1,3-thiazol-2-yl)pyrazine-2-carboxamide?
The canonical SMILES for 3-amino-N-(4-methyl-1,3-thiazol-2-yl)pyrazine-2-carboxamide is Cc1csc(NC(=O)c2nccnc2N)n1.
What is the InChIKey of 3-amino-N-(4-methyl-1,3-thiazol-2-yl)pyrazine-2-carboxamide?
The InChIKey is MYGYSJAPCUOJCO-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H9N5OS/c1-5-4-16-9(13-5)14-8(15)6-7(10)12-3-2-11-6/h2-4H,1H3,(H2,10,12)(H,13,14,15).
What are the key properties of 3-amino-N-(4-methyl-1,3-thiazol-2-yl)pyrazine-2-carboxamide?
3-amino-N-(4-methyl-1,3-thiazol-2-yl)pyrazine-2-carboxamide has a molecular weight of 235.27 g/mol, XLogP of 1.08, 2 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-(4-methyl-1,3-thiazol-2-yl)pyrazine-2-carboxamide is sourced from PubChem (CID 18138823), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).