5-cyclopropyl-2-methyl-1,3-thiazole-4-carboxamide

C8H10N2OS — CID 68943192

IUPAC5-cyclopropyl-2-methyl-1,3-thiazole-4-carboxamide
SMILESCc1nc(C(N)=O)c(C2CC2)s1
InChIInChI=1S/C8H10N2OS/c1-4-10-6(8(9)11)7(12-4)5-2-3-5/h5H,2-3H2,1H3,(H2,9,11)
InChIKeyZIRYJLCIIGPICV-UHFFFAOYSA-N
MW182.25 g/mol
LogP1.43
Rot. Bonds2

About 5-cyclopropyl-2-methyl-1,3-thiazole-4-carboxamide

5-cyclopropyl-2-methyl-1,3-thiazole-4-carboxamide (PubChem CID 68943192) has the molecular formula C8H10N2OS and a molecular weight of 182.25 g/mol. Its IUPAC name is 5-cyclopropyl-2-methyl-1,3-thiazole-4-carboxamide.

Molecular Properties

Compound Name5-cyclopropyl-2-methyl-1,3-thiazole-4-carboxamide
PubChem CID68943192
Molecular FormulaC8H10N2OS
Molecular Weight182.25 g/mol
Exact Mass182.05
IUPAC Name5-cyclopropyl-2-methyl-1,3-thiazole-4-carboxamide
SMILESCc1nc(C(N)=O)c(C2CC2)s1
InChIInChI=1S/C8H10N2OS/c1-4-10-6(8(9)11)7(12-4)5-2-3-5/h5H,2-3H2,1H3,(H2,9,11)
InChIKeyZIRYJLCIIGPICV-UHFFFAOYSA-N
XLogP1.43
TPSA55.98 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.25
LogP ≤ 51.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-cyclopropyl-2-methyl-1,3-thiazole-4-carboxamide?
The IUPAC name of 5-cyclopropyl-2-methyl-1,3-thiazole-4-carboxamide (CID 68943192) is 5-cyclopropyl-2-methyl-1,3-thiazole-4-carboxamide.
What is the SMILES notation for 5-cyclopropyl-2-methyl-1,3-thiazole-4-carboxamide?
The canonical SMILES for 5-cyclopropyl-2-methyl-1,3-thiazole-4-carboxamide is Cc1nc(C(N)=O)c(C2CC2)s1.
What is the InChIKey of 5-cyclopropyl-2-methyl-1,3-thiazole-4-carboxamide?
The InChIKey is ZIRYJLCIIGPICV-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10N2OS/c1-4-10-6(8(9)11)7(12-4)5-2-3-5/h5H,2-3H2,1H3,(H2,9,11).
What are the key properties of 5-cyclopropyl-2-methyl-1,3-thiazole-4-carboxamide?
5-cyclopropyl-2-methyl-1,3-thiazole-4-carboxamide has a molecular weight of 182.25 g/mol, XLogP of 1.43, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-cyclopropyl-2-methyl-1,3-thiazole-4-carboxamide is sourced from PubChem (CID 68943192), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).