N-(5-ethyl-1,3,4-thiadiazol-2-yl)-2,4-dimethyl-1,3-thiazole-5-carboxamide

C10H12N4OS2 — CID 7540989

IUPACN-(5-ethyl-1,3,4-thiadiazol-2-yl)-2,4-dimethyl-1,3-thiazole-5-carboxamide
SMILESCCc1nnc(NC(=O)c2sc(C)nc2C)s1
InChIInChI=1S/C10H12N4OS2/c1-4-7-13-14-10(17-7)12-9(15)8-5(2)11-6(3)16-8/h4H2,1-3H3,(H,12,14,15)
InChIKeyXVGBMHNTPQDABQ-UHFFFAOYSA-N
MW268.37 g/mol
LogP2.43
Rot. Bonds3

About N-(5-ethyl-1,3,4-thiadiazol-2-yl)-2,4-dimethyl-1,3-thiazole-5-carboxamide

N-(5-ethyl-1,3,4-thiadiazol-2-yl)-2,4-dimethyl-1,3-thiazole-5-carboxamide (PubChem CID 7540989) has the molecular formula C10H12N4OS2 and a molecular weight of 268.37 g/mol. Its IUPAC name is N-(5-ethyl-1,3,4-thiadiazol-2-yl)-2,4-dimethyl-1,3-thiazole-5-carboxamide.

Molecular Properties

Compound NameN-(5-ethyl-1,3,4-thiadiazol-2-yl)-2,4-dimethyl-1,3-thiazole-5-carboxamide
PubChem CID7540989
Molecular FormulaC10H12N4OS2
Molecular Weight268.37 g/mol
Exact Mass268.05
IUPAC NameN-(5-ethyl-1,3,4-thiadiazol-2-yl)-2,4-dimethyl-1,3-thiazole-5-carboxamide
SMILESCCc1nnc(NC(=O)c2sc(C)nc2C)s1
InChIInChI=1S/C10H12N4OS2/c1-4-7-13-14-10(17-7)12-9(15)8-5(2)11-6(3)16-8/h4H2,1-3H3,(H,12,14,15)
InChIKeyXVGBMHNTPQDABQ-UHFFFAOYSA-N
XLogP2.43
TPSA67.77 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.37
LogP ≤ 52.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-(5-ethyl-1,3,4-thiadiazol-2-yl)-2,4-dimethyl-1,3-thiazole-5-carboxamide?
The IUPAC name of N-(5-ethyl-1,3,4-thiadiazol-2-yl)-2,4-dimethyl-1,3-thiazole-5-carboxamide (CID 7540989) is N-(5-ethyl-1,3,4-thiadiazol-2-yl)-2,4-dimethyl-1,3-thiazole-5-carboxamide.
What is the SMILES notation for N-(5-ethyl-1,3,4-thiadiazol-2-yl)-2,4-dimethyl-1,3-thiazole-5-carboxamide?
The canonical SMILES for N-(5-ethyl-1,3,4-thiadiazol-2-yl)-2,4-dimethyl-1,3-thiazole-5-carboxamide is CCc1nnc(NC(=O)c2sc(C)nc2C)s1.
What is the InChIKey of N-(5-ethyl-1,3,4-thiadiazol-2-yl)-2,4-dimethyl-1,3-thiazole-5-carboxamide?
The InChIKey is XVGBMHNTPQDABQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12N4OS2/c1-4-7-13-14-10(17-7)12-9(15)8-5(2)11-6(3)16-8/h4H2,1-3H3,(H,12,14,15).
What are the key properties of N-(5-ethyl-1,3,4-thiadiazol-2-yl)-2,4-dimethyl-1,3-thiazole-5-carboxamide?
N-(5-ethyl-1,3,4-thiadiazol-2-yl)-2,4-dimethyl-1,3-thiazole-5-carboxamide has a molecular weight of 268.37 g/mol, XLogP of 2.43, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-ethyl-1,3,4-thiadiazol-2-yl)-2,4-dimethyl-1,3-thiazole-5-carboxamide is sourced from PubChem (CID 7540989), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).