N-ethyl-4-methylthiadiazole-5-carboxamide

C6H9N3OS — CID 60660728

IUPACN-ethyl-4-methylthiadiazole-5-carboxamide
SMILESCCNC(=O)c1snnc1C
InChIInChI=1S/C6H9N3OS/c1-3-7-6(10)5-4(2)8-9-11-5/h3H2,1-2H3,(H,7,10)
InChIKeyFLLKUZMLSQMUKW-UHFFFAOYSA-N
MW171.22 g/mol
LogP0.60
Rot. Bonds2

About N-ethyl-4-methylthiadiazole-5-carboxamide

N-ethyl-4-methylthiadiazole-5-carboxamide (PubChem CID 60660728) has the molecular formula C6H9N3OS and a molecular weight of 171.22 g/mol. Its IUPAC name is N-ethyl-4-methylthiadiazole-5-carboxamide.

Molecular Properties

Compound NameN-ethyl-4-methylthiadiazole-5-carboxamide
PubChem CID60660728
Molecular FormulaC6H9N3OS
Molecular Weight171.22 g/mol
Exact Mass171.05
IUPAC NameN-ethyl-4-methylthiadiazole-5-carboxamide
SMILESCCNC(=O)c1snnc1C
InChIInChI=1S/C6H9N3OS/c1-3-7-6(10)5-4(2)8-9-11-5/h3H2,1-2H3,(H,7,10)
InChIKeyFLLKUZMLSQMUKW-UHFFFAOYSA-N
XLogP0.60
TPSA54.88 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500171.22
LogP ≤ 50.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-methyl-N-[3-(methylamino)propyl]thiadiazole-5-carboxamide
CID 43600601
N-[2-ethyl-2-(hydroxymethyl)butyl]-4-methylthiadiazole-5-carboxamide
CID 102999194
N-cyano-4-methylthiadiazole-5-carboxamide
CID 79195320
2,2-dimethyl-3-[(4-methylthiadiazole-5-carbonyl)amino]propanoic acid
CID 115427027
N-ethyl-4-(4-methylphenyl)thiadiazole-5-carboxamide
CID 100748441
N-(3-bromobutyl)-4-methylthiadiazole-5-carboxamide
CID 114312469
3-methyl-2-[[(4-methylthiadiazole-5-carbonyl)amino]methyl]butanoic acid
CID 65220608
4-methyl-N-[(4-methylcyclohexyl)methyl]thiadiazole-5-carboxamide
CID 154862352
N-[(1-aminocyclobutyl)methyl]-4-methylthiadiazole-5-carboxamide
CID 103352583
N-(2-hydroxy-4,4-dimethylpentyl)-4-methylthiadiazole-5-carboxamide
CID 102979948
N-[(4-methoxyphenyl)methyl]-4-methylthiadiazole-5-carboxamide
CID 7576735
N-(2-bromo-3-methoxypropyl)-4-methylthiadiazole-5-carboxamide
CID 114309922

Frequently Asked Questions

What is the IUPAC name of N-ethyl-4-methylthiadiazole-5-carboxamide?
The IUPAC name of N-ethyl-4-methylthiadiazole-5-carboxamide (CID 60660728) is N-ethyl-4-methylthiadiazole-5-carboxamide.
What is the SMILES notation for N-ethyl-4-methylthiadiazole-5-carboxamide?
The canonical SMILES for N-ethyl-4-methylthiadiazole-5-carboxamide is CCNC(=O)c1snnc1C.
What is the InChIKey of N-ethyl-4-methylthiadiazole-5-carboxamide?
The InChIKey is FLLKUZMLSQMUKW-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H9N3OS/c1-3-7-6(10)5-4(2)8-9-11-5/h3H2,1-2H3,(H,7,10).
What are the key properties of N-ethyl-4-methylthiadiazole-5-carboxamide?
N-ethyl-4-methylthiadiazole-5-carboxamide has a molecular weight of 171.22 g/mol, XLogP of 0.60, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-4-methylthiadiazole-5-carboxamide is sourced from PubChem (CID 60660728), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).