1-ethyl-3,5-dimethyl-N-(5-methyl-1,3-thiazol-2-yl)pyrazole-4-sulfonamide

C11H16N4O2S2 — CID 35764666

IUPAC1-ethyl-3,5-dimethyl-N-(5-methyl-1,3-thiazol-2-yl)pyrazole-4-sulfonamide
SMILESCCn1nc(C)c(S(=O)(=O)Nc2ncc(C)s2)c1C
InChIInChI=1S/C11H16N4O2S2/c1-5-15-9(4)10(8(3)13-15)19(16,17)14-11-12-6-7(2)18-11/h6H,5H2,1-4H3,(H,12,14)
InChIKeyHAJZRCTUZSVUFY-UHFFFAOYSA-N
MW300.41 g/mol
LogP2.09
Rot. Bonds4

About 1-ethyl-3,5-dimethyl-N-(5-methyl-1,3-thiazol-2-yl)pyrazole-4-sulfonamide

1-ethyl-3,5-dimethyl-N-(5-methyl-1,3-thiazol-2-yl)pyrazole-4-sulfonamide (PubChem CID 35764666) has the molecular formula C11H16N4O2S2 and a molecular weight of 300.41 g/mol. Its IUPAC name is 1-ethyl-3,5-dimethyl-N-(5-methyl-1,3-thiazol-2-yl)pyrazole-4-sulfonamide.

Molecular Properties

Compound Name1-ethyl-3,5-dimethyl-N-(5-methyl-1,3-thiazol-2-yl)pyrazole-4-sulfonamide
PubChem CID35764666
Molecular FormulaC11H16N4O2S2
Molecular Weight300.41 g/mol
Exact Mass300.07
IUPAC Name1-ethyl-3,5-dimethyl-N-(5-methyl-1,3-thiazol-2-yl)pyrazole-4-sulfonamide
SMILESCCn1nc(C)c(S(=O)(=O)Nc2ncc(C)s2)c1C
InChIInChI=1S/C11H16N4O2S2/c1-5-15-9(4)10(8(3)13-15)19(16,17)14-11-12-6-7(2)18-11/h6H,5H2,1-4H3,(H,12,14)
InChIKeyHAJZRCTUZSVUFY-UHFFFAOYSA-N
XLogP2.09
TPSA76.88 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.41
LogP ≤ 52.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 1-ethyl-3,5-dimethyl-N-(5-methyl-1,3-thiazol-2-yl)pyrazole-4-sulfonamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 1-ethyl-3,5-dimethyl-N-(5-methyl-1,3-thiazol-2-yl)pyrazole-4-sulfonamide?
The IUPAC name of 1-ethyl-3,5-dimethyl-N-(5-methyl-1,3-thiazol-2-yl)pyrazole-4-sulfonamide (CID 35764666) is 1-ethyl-3,5-dimethyl-N-(5-methyl-1,3-thiazol-2-yl)pyrazole-4-sulfonamide.
What is the SMILES notation for 1-ethyl-3,5-dimethyl-N-(5-methyl-1,3-thiazol-2-yl)pyrazole-4-sulfonamide?
The canonical SMILES for 1-ethyl-3,5-dimethyl-N-(5-methyl-1,3-thiazol-2-yl)pyrazole-4-sulfonamide is CCn1nc(C)c(S(=O)(=O)Nc2ncc(C)s2)c1C.
What is the InChIKey of 1-ethyl-3,5-dimethyl-N-(5-methyl-1,3-thiazol-2-yl)pyrazole-4-sulfonamide?
The InChIKey is HAJZRCTUZSVUFY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N4O2S2/c1-5-15-9(4)10(8(3)13-15)19(16,17)14-11-12-6-7(2)18-11/h6H,5H2,1-4H3,(H,12,14).
What are the key properties of 1-ethyl-3,5-dimethyl-N-(5-methyl-1,3-thiazol-2-yl)pyrazole-4-sulfonamide?
1-ethyl-3,5-dimethyl-N-(5-methyl-1,3-thiazol-2-yl)pyrazole-4-sulfonamide has a molecular weight of 300.41 g/mol, XLogP of 2.09, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-3,5-dimethyl-N-(5-methyl-1,3-thiazol-2-yl)pyrazole-4-sulfonamide is sourced from PubChem (CID 35764666), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).