2-amino-N,4-dimethyl-1,3-thiazole-5-carboxamide

C6H9N3OS — CID 45058673

IUPAC2-amino-N,4-dimethyl-1,3-thiazole-5-carboxamide
SMILESCNC(=O)c1sc(N)nc1C
InChIInChI=1S/C6H9N3OS/c1-3-4(5(10)8-2)11-6(7)9-3/h1-2H3,(H2,7,9)(H,8,10)
InChIKeyNHTFMXNKBMJNCP-UHFFFAOYSA-N
MW171.22 g/mol
LogP0.39
Rot. Bonds1

About 2-amino-N,4-dimethyl-1,3-thiazole-5-carboxamide

2-amino-N,4-dimethyl-1,3-thiazole-5-carboxamide (PubChem CID 45058673) has the molecular formula C6H9N3OS and a molecular weight of 171.22 g/mol. Its IUPAC name is 2-amino-N,4-dimethyl-1,3-thiazole-5-carboxamide.

Molecular Properties

Compound Name2-amino-N,4-dimethyl-1,3-thiazole-5-carboxamide
PubChem CID45058673
Molecular FormulaC6H9N3OS
Molecular Weight171.22 g/mol
Exact Mass171.05
IUPAC Name2-amino-N,4-dimethyl-1,3-thiazole-5-carboxamide
SMILESCNC(=O)c1sc(N)nc1C
InChIInChI=1S/C6H9N3OS/c1-3-4(5(10)8-2)11-6(7)9-3/h1-2H3,(H2,7,9)(H,8,10)
InChIKeyNHTFMXNKBMJNCP-UHFFFAOYSA-N
XLogP0.39
TPSA68.01 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500171.22
LogP ≤ 50.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-amino-4-methyl-N-[2-(methylamino)-2-oxoethyl]-1,3-thiazole-5-carboxamide
CID 62794600
2-amino-4-methyl-N-[4-(methylcarbamoyl)phenyl]-1,3-thiazole-5-carboxamide
CID 62792729
2-amino-N-(2,5-dimethylpyrrol-1-yl)-4-methyl-1,3-thiazole-5-carboxamide
CID 79101089
2-amino-4-methyl-N-(2,3,5,6-tetrafluorophenyl)-1,3-thiazole-5-carboxamide
CID 107641671
2-amino-N-(5,6-dimethyl-1,2,4-triazin-3-yl)-4-methyl-1,3-thiazole-5-carboxamide
CID 114387542
2-amino-N-(2-amino-2-oxoethoxy)-4-methyl-1,3-thiazole-5-carboxamide
CID 112674174
2-amino-4-methyl-N-phenyl-1,3-thiazole-5-carboxamide
CID 735558
2-amino-N-(dicyclopropylmethyl)-4-methyl-1,3-thiazole-5-carboxamide
CID 62792433
2-amino-4-methyl-N-[[3-(methylcarbamoyl)phenyl]methyl]-1,3-thiazole-5-carboxamide
CID 91766936
2-amino-N,N,4-trimethyl-1,3-thiazole-5-carboxamide
CID 673715
2-amino-N-(2,3-dihydroxypropyl)-4-methyl-1,3-thiazole-5-carboxamide
CID 66168708
(2S)-3-[(2-amino-4-methyl-1,3-thiazole-5-carbonyl)amino]-2-hydroxypropanoic acid
CID 107835738

Frequently Asked Questions

What is the IUPAC name of 2-amino-N,4-dimethyl-1,3-thiazole-5-carboxamide?
The IUPAC name of 2-amino-N,4-dimethyl-1,3-thiazole-5-carboxamide (CID 45058673) is 2-amino-N,4-dimethyl-1,3-thiazole-5-carboxamide.
What is the SMILES notation for 2-amino-N,4-dimethyl-1,3-thiazole-5-carboxamide?
The canonical SMILES for 2-amino-N,4-dimethyl-1,3-thiazole-5-carboxamide is CNC(=O)c1sc(N)nc1C.
What is the InChIKey of 2-amino-N,4-dimethyl-1,3-thiazole-5-carboxamide?
The InChIKey is NHTFMXNKBMJNCP-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H9N3OS/c1-3-4(5(10)8-2)11-6(7)9-3/h1-2H3,(H2,7,9)(H,8,10).
What are the key properties of 2-amino-N,4-dimethyl-1,3-thiazole-5-carboxamide?
2-amino-N,4-dimethyl-1,3-thiazole-5-carboxamide has a molecular weight of 171.22 g/mol, XLogP of 0.39, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N,4-dimethyl-1,3-thiazole-5-carboxamide is sourced from PubChem (CID 45058673), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).