2-(ethylamino)-N-methyl-N-(pyrazin-2-ylmethyl)-1,3-thiazole-4-carboxamide

C12H15N5OS — CID 71914754

IUPAC2-(ethylamino)-N-methyl-N-(pyrazin-2-ylmethyl)-1,3-thiazole-4-carboxamide
SMILESCCNc1nc(C(=O)N(C)Cc2cnccn2)cs1
InChIInChI=1S/C12H15N5OS/c1-3-14-12-16-10(8-19-12)11(18)17(2)7-9-6-13-4-5-15-9/h4-6,8H,3,7H2,1-2H3,(H,14,16)
InChIKeyONQYORRJMNLRJA-UHFFFAOYSA-N
MW277.35 g/mol
LogP1.64
Rot. Bonds5

About 2-(ethylamino)-N-methyl-N-(pyrazin-2-ylmethyl)-1,3-thiazole-4-carboxamide

2-(ethylamino)-N-methyl-N-(pyrazin-2-ylmethyl)-1,3-thiazole-4-carboxamide (PubChem CID 71914754) has the molecular formula C12H15N5OS and a molecular weight of 277.35 g/mol. Its IUPAC name is 2-(ethylamino)-N-methyl-N-(pyrazin-2-ylmethyl)-1,3-thiazole-4-carboxamide.

Molecular Properties

Compound Name2-(ethylamino)-N-methyl-N-(pyrazin-2-ylmethyl)-1,3-thiazole-4-carboxamide
PubChem CID71914754
Molecular FormulaC12H15N5OS
Molecular Weight277.35 g/mol
Exact Mass277.10
IUPAC Name2-(ethylamino)-N-methyl-N-(pyrazin-2-ylmethyl)-1,3-thiazole-4-carboxamide
SMILESCCNc1nc(C(=O)N(C)Cc2cnccn2)cs1
InChIInChI=1S/C12H15N5OS/c1-3-14-12-16-10(8-19-12)11(18)17(2)7-9-6-13-4-5-15-9/h4-6,8H,3,7H2,1-2H3,(H,14,16)
InChIKeyONQYORRJMNLRJA-UHFFFAOYSA-N
XLogP1.64
TPSA71.01 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.35
LogP ≤ 51.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 2-(ethylamino)-N-methyl-N-(pyrazin-2-ylmethyl)-1,3-thiazole-4-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-(ethylamino)-N-methyl-N-(pyrazin-2-ylmethyl)-1,3-thiazole-4-carboxamide?
The IUPAC name of 2-(ethylamino)-N-methyl-N-(pyrazin-2-ylmethyl)-1,3-thiazole-4-carboxamide (CID 71914754) is 2-(ethylamino)-N-methyl-N-(pyrazin-2-ylmethyl)-1,3-thiazole-4-carboxamide.
What is the SMILES notation for 2-(ethylamino)-N-methyl-N-(pyrazin-2-ylmethyl)-1,3-thiazole-4-carboxamide?
The canonical SMILES for 2-(ethylamino)-N-methyl-N-(pyrazin-2-ylmethyl)-1,3-thiazole-4-carboxamide is CCNc1nc(C(=O)N(C)Cc2cnccn2)cs1.
What is the InChIKey of 2-(ethylamino)-N-methyl-N-(pyrazin-2-ylmethyl)-1,3-thiazole-4-carboxamide?
The InChIKey is ONQYORRJMNLRJA-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15N5OS/c1-3-14-12-16-10(8-19-12)11(18)17(2)7-9-6-13-4-5-15-9/h4-6,8H,3,7H2,1-2H3,(H,14,16).
What are the key properties of 2-(ethylamino)-N-methyl-N-(pyrazin-2-ylmethyl)-1,3-thiazole-4-carboxamide?
2-(ethylamino)-N-methyl-N-(pyrazin-2-ylmethyl)-1,3-thiazole-4-carboxamide has a molecular weight of 277.35 g/mol, XLogP of 1.64, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(ethylamino)-N-methyl-N-(pyrazin-2-ylmethyl)-1,3-thiazole-4-carboxamide is sourced from PubChem (CID 71914754), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).