4-cyclopropyl-N-(5-methyl-1,3,4-thiadiazol-2-yl)-1,3-thiazole-5-carboxamide

C10H10N4OS2 — CID 126780096

IUPAC4-cyclopropyl-N-(5-methyl-1,3,4-thiadiazol-2-yl)-1,3-thiazole-5-carboxamide
SMILESCc1nnc(NC(=O)c2scnc2C2CC2)s1
InChIInChI=1S/C10H10N4OS2/c1-5-13-14-10(17-5)12-9(15)8-7(6-2-3-6)11-4-16-8/h4,6H,2-3H2,1H3,(H,12,14,15)
InChIKeyJNQXLCIKQDNQIV-UHFFFAOYSA-N
MW266.35 g/mol
LogP2.43
Rot. Bonds3

About 4-cyclopropyl-N-(5-methyl-1,3,4-thiadiazol-2-yl)-1,3-thiazole-5-carboxamide

4-cyclopropyl-N-(5-methyl-1,3,4-thiadiazol-2-yl)-1,3-thiazole-5-carboxamide (PubChem CID 126780096) has the molecular formula C10H10N4OS2 and a molecular weight of 266.35 g/mol. Its IUPAC name is 4-cyclopropyl-N-(5-methyl-1,3,4-thiadiazol-2-yl)-1,3-thiazole-5-carboxamide.

Molecular Properties

Compound Name4-cyclopropyl-N-(5-methyl-1,3,4-thiadiazol-2-yl)-1,3-thiazole-5-carboxamide
PubChem CID126780096
Molecular FormulaC10H10N4OS2
Molecular Weight266.35 g/mol
Exact Mass266.03
IUPAC Name4-cyclopropyl-N-(5-methyl-1,3,4-thiadiazol-2-yl)-1,3-thiazole-5-carboxamide
SMILESCc1nnc(NC(=O)c2scnc2C2CC2)s1
InChIInChI=1S/C10H10N4OS2/c1-5-13-14-10(17-5)12-9(15)8-7(6-2-3-6)11-4-16-8/h4,6H,2-3H2,1H3,(H,12,14,15)
InChIKeyJNQXLCIKQDNQIV-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 ≤ 500266.35
LogP ≤ 52.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 4-cyclopropyl-N-(5-methyl-1,3,4-thiadiazol-2-yl)-1,3-thiazole-5-carboxamide?
The IUPAC name of 4-cyclopropyl-N-(5-methyl-1,3,4-thiadiazol-2-yl)-1,3-thiazole-5-carboxamide (CID 126780096) is 4-cyclopropyl-N-(5-methyl-1,3,4-thiadiazol-2-yl)-1,3-thiazole-5-carboxamide.
What is the SMILES notation for 4-cyclopropyl-N-(5-methyl-1,3,4-thiadiazol-2-yl)-1,3-thiazole-5-carboxamide?
The canonical SMILES for 4-cyclopropyl-N-(5-methyl-1,3,4-thiadiazol-2-yl)-1,3-thiazole-5-carboxamide is Cc1nnc(NC(=O)c2scnc2C2CC2)s1.
What is the InChIKey of 4-cyclopropyl-N-(5-methyl-1,3,4-thiadiazol-2-yl)-1,3-thiazole-5-carboxamide?
The InChIKey is JNQXLCIKQDNQIV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10N4OS2/c1-5-13-14-10(17-5)12-9(15)8-7(6-2-3-6)11-4-16-8/h4,6H,2-3H2,1H3,(H,12,14,15).
What are the key properties of 4-cyclopropyl-N-(5-methyl-1,3,4-thiadiazol-2-yl)-1,3-thiazole-5-carboxamide?
4-cyclopropyl-N-(5-methyl-1,3,4-thiadiazol-2-yl)-1,3-thiazole-5-carboxamide has a molecular weight of 266.35 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 4-cyclopropyl-N-(5-methyl-1,3,4-thiadiazol-2-yl)-1,3-thiazole-5-carboxamide is sourced from PubChem (CID 126780096), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).