5-N,5-N-dimethyl-1,3-thiazole-4,5-dicarboxamide

C7H9N3O2S — CID 140546289

IUPAC5-N,5-N-dimethyl-1,3-thiazole-4,5-dicarboxamide
SMILESCN(C)C(=O)c1scnc1C(N)=O
InChIInChI=1S/C7H9N3O2S/c1-10(2)7(12)5-4(6(8)11)9-3-13-5/h3H,1-2H3,(H2,8,11)
InChIKeyZEIGFJFUXJJJNA-UHFFFAOYSA-N
MW199.24 g/mol
LogP-0.06
Rot. Bonds2

About 5-N,5-N-dimethyl-1,3-thiazole-4,5-dicarboxamide

5-N,5-N-dimethyl-1,3-thiazole-4,5-dicarboxamide (PubChem CID 140546289) has the molecular formula C7H9N3O2S and a molecular weight of 199.24 g/mol. Its IUPAC name is 5-N,5-N-dimethyl-1,3-thiazole-4,5-dicarboxamide.

Molecular Properties

Compound Name5-N,5-N-dimethyl-1,3-thiazole-4,5-dicarboxamide
PubChem CID140546289
Molecular FormulaC7H9N3O2S
Molecular Weight199.24 g/mol
Exact Mass199.04
IUPAC Name5-N,5-N-dimethyl-1,3-thiazole-4,5-dicarboxamide
SMILESCN(C)C(=O)c1scnc1C(N)=O
InChIInChI=1S/C7H9N3O2S/c1-10(2)7(12)5-4(6(8)11)9-3-13-5/h3H,1-2H3,(H2,8,11)
InChIKeyZEIGFJFUXJJJNA-UHFFFAOYSA-N
XLogP-0.06
TPSA76.29 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.24
LogP ≤ 5-0.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N,N-dimethyl-4-(trifluoromethyl)-1,3-thiazole-5-carboxamide
CID 84561087
3-amino-N,N-dimethylthiophene-2-carboxamide
CID 61092296
N-(1-amino-1-hydroxyiminopropan-2-yl)-N,4-dimethyl-1,3-thiazole-5-carboxamide
CID 76928134
4-(ethylcarbamoyl)-1,3-thiazole-5-carboxylic acid
CID 117214964
2-N,2-N-dimethylthiophene-2,5-dicarboxamide
CID 126988322
4-methoxycarbonyl-1,3-thiazole-5-carboxylic acid
CID 117214962
[4-amino-2-(dimethylcarbamoyl)thiophen-3-yl]oxidanium
CID 142233969
N-[2-(dimethylamino)ethyl]-5-methyl-1,3-thiazole-4-carboxamide
CID 110849548
N-(3-amino-2,2-dimethylpropyl)-N,4-dimethyl-1,3-thiazole-5-carboxamide
CID 79652972
N-(2-amino-2-sulfanylideneethyl)-4-methyl-1,3-thiazole-5-carboxamide
CID 61126703
methyl 2-methyl-3-[methyl-(4-methyl-1,3-thiazole-5-carbonyl)amino]propanoate
CID 55008025
methyl 5-amino-1,3-thiazole-4-carboxylate
CID 53408092

Frequently Asked Questions

What is the IUPAC name of 5-N,5-N-dimethyl-1,3-thiazole-4,5-dicarboxamide?
The IUPAC name of 5-N,5-N-dimethyl-1,3-thiazole-4,5-dicarboxamide (CID 140546289) is 5-N,5-N-dimethyl-1,3-thiazole-4,5-dicarboxamide.
What is the SMILES notation for 5-N,5-N-dimethyl-1,3-thiazole-4,5-dicarboxamide?
The canonical SMILES for 5-N,5-N-dimethyl-1,3-thiazole-4,5-dicarboxamide is CN(C)C(=O)c1scnc1C(N)=O.
What is the InChIKey of 5-N,5-N-dimethyl-1,3-thiazole-4,5-dicarboxamide?
The InChIKey is ZEIGFJFUXJJJNA-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H9N3O2S/c1-10(2)7(12)5-4(6(8)11)9-3-13-5/h3H,1-2H3,(H2,8,11).
What are the key properties of 5-N,5-N-dimethyl-1,3-thiazole-4,5-dicarboxamide?
5-N,5-N-dimethyl-1,3-thiazole-4,5-dicarboxamide has a molecular weight of 199.24 g/mol, XLogP of -0.06, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-N,5-N-dimethyl-1,3-thiazole-4,5-dicarboxamide is sourced from PubChem (CID 140546289), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).