2-amino-N-(5,6-diethyl-1,2,4-triazin-3-yl)-1,3-thiazole-4-carboxamide

C11H14N6OS — CID 114387594

IUPAC2-amino-N-(5,6-diethyl-1,2,4-triazin-3-yl)-1,3-thiazole-4-carboxamide
SMILESCCc1nnc(NC(=O)c2csc(N)n2)nc1CC
InChIInChI=1S/C11H14N6OS/c1-3-6-7(4-2)16-17-11(14-6)15-9(18)8-5-19-10(12)13-8/h5H,3-4H2,1-2H3,(H2,12,13)(H,14,15,17,18)
InChIKeyWUJKLKGKACEWIW-UHFFFAOYSA-N
MW278.34 g/mol
LogP1.29
Rot. Bonds4

About 2-amino-N-(5,6-diethyl-1,2,4-triazin-3-yl)-1,3-thiazole-4-carboxamide

2-amino-N-(5,6-diethyl-1,2,4-triazin-3-yl)-1,3-thiazole-4-carboxamide (PubChem CID 114387594) has the molecular formula C11H14N6OS and a molecular weight of 278.34 g/mol. Its IUPAC name is 2-amino-N-(5,6-diethyl-1,2,4-triazin-3-yl)-1,3-thiazole-4-carboxamide.

Molecular Properties

Compound Name2-amino-N-(5,6-diethyl-1,2,4-triazin-3-yl)-1,3-thiazole-4-carboxamide
PubChem CID114387594
Molecular FormulaC11H14N6OS
Molecular Weight278.34 g/mol
Exact Mass278.09
IUPAC Name2-amino-N-(5,6-diethyl-1,2,4-triazin-3-yl)-1,3-thiazole-4-carboxamide
SMILESCCc1nnc(NC(=O)c2csc(N)n2)nc1CC
InChIInChI=1S/C11H14N6OS/c1-3-6-7(4-2)16-17-11(14-6)15-9(18)8-5-19-10(12)13-8/h5H,3-4H2,1-2H3,(H2,12,13)(H,14,15,17,18)
InChIKeyWUJKLKGKACEWIW-UHFFFAOYSA-N
XLogP1.29
TPSA106.68 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.34
LogP ≤ 51.29
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

Analyze 2-amino-N-(5,6-diethyl-1,2,4-triazin-3-yl)-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-amino-N-(5,6-diethyl-1,2,4-triazin-3-yl)-1,3-thiazole-4-carboxamide?
The IUPAC name of 2-amino-N-(5,6-diethyl-1,2,4-triazin-3-yl)-1,3-thiazole-4-carboxamide (CID 114387594) is 2-amino-N-(5,6-diethyl-1,2,4-triazin-3-yl)-1,3-thiazole-4-carboxamide.
What is the SMILES notation for 2-amino-N-(5,6-diethyl-1,2,4-triazin-3-yl)-1,3-thiazole-4-carboxamide?
The canonical SMILES for 2-amino-N-(5,6-diethyl-1,2,4-triazin-3-yl)-1,3-thiazole-4-carboxamide is CCc1nnc(NC(=O)c2csc(N)n2)nc1CC.
What is the InChIKey of 2-amino-N-(5,6-diethyl-1,2,4-triazin-3-yl)-1,3-thiazole-4-carboxamide?
The InChIKey is WUJKLKGKACEWIW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N6OS/c1-3-6-7(4-2)16-17-11(14-6)15-9(18)8-5-19-10(12)13-8/h5H,3-4H2,1-2H3,(H2,12,13)(H,14,15,17,18).
What are the key properties of 2-amino-N-(5,6-diethyl-1,2,4-triazin-3-yl)-1,3-thiazole-4-carboxamide?
2-amino-N-(5,6-diethyl-1,2,4-triazin-3-yl)-1,3-thiazole-4-carboxamide has a molecular weight of 278.34 g/mol, XLogP of 1.29, 4 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(5,6-diethyl-1,2,4-triazin-3-yl)-1,3-thiazole-4-carboxamide is sourced from PubChem (CID 114387594), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).