4-methyl-2-oxo-N-(5-pyrrolidin-2-yl-1,3,4-oxadiazol-2-yl)-3H-1,3-thiazole-5-sulfonamide

C10H13N5O4S2 — CID 102703654

IUPAC4-methyl-2-oxo-N-(5-pyrrolidin-2-yl-1,3,4-oxadiazol-2-yl)-3H-1,3-thiazole-5-sulfonamide
SMILESCc1[nH]c(=O)sc1S(=O)(=O)Nc1nnc(C2CCCN2)o1
InChIInChI=1S/C10H13N5O4S2/c1-5-8(20-10(16)12-5)21(17,18)15-9-14-13-7(19-9)6-3-2-4-11-6/h6,11H,2-4H2,1H3,(H,12,16)(H,14,15)
InChIKeyRZUDDJLGWGASPM-UHFFFAOYSA-N
MW331.38 g/mol
LogP0.35
Rot. Bonds4

About 4-methyl-2-oxo-N-(5-pyrrolidin-2-yl-1,3,4-oxadiazol-2-yl)-3H-1,3-thiazole-5-sulfonamide

4-methyl-2-oxo-N-(5-pyrrolidin-2-yl-1,3,4-oxadiazol-2-yl)-3H-1,3-thiazole-5-sulfonamide (PubChem CID 102703654) has the molecular formula C10H13N5O4S2 and a molecular weight of 331.38 g/mol. Its IUPAC name is 4-methyl-2-oxo-N-(5-pyrrolidin-2-yl-1,3,4-oxadiazol-2-yl)-3H-1,3-thiazole-5-sulfonamide.

Molecular Properties

Compound Name4-methyl-2-oxo-N-(5-pyrrolidin-2-yl-1,3,4-oxadiazol-2-yl)-3H-1,3-thiazole-5-sulfonamide
PubChem CID102703654
Molecular FormulaC10H13N5O4S2
Molecular Weight331.38 g/mol
Exact Mass331.04
IUPAC Name4-methyl-2-oxo-N-(5-pyrrolidin-2-yl-1,3,4-oxadiazol-2-yl)-3H-1,3-thiazole-5-sulfonamide
SMILESCc1[nH]c(=O)sc1S(=O)(=O)Nc1nnc(C2CCCN2)o1
InChIInChI=1S/C10H13N5O4S2/c1-5-8(20-10(16)12-5)21(17,18)15-9-14-13-7(19-9)6-3-2-4-11-6/h6,11H,2-4H2,1H3,(H,12,16)(H,14,15)
InChIKeyRZUDDJLGWGASPM-UHFFFAOYSA-N
XLogP0.35
TPSA129.98 Ų
H-Bond Donors3
H-Bond Acceptors8
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500331.38
LogP ≤ 50.35
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 108

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Related Compounds

2-methyl-N-(5-pyrrolidin-2-yl-1,3,4-oxadiazol-2-yl)-1H-imidazole-5-sulfonamide
CID 102703739
1-cyclopropyl-N-(5-pyrrolidin-2-yl-1,3,4-oxadiazol-2-yl)methanesulfonamide
CID 102703702
2-fluoro-N-(5-pyrrolidin-2-yl-1,3,4-oxadiazol-2-yl)benzenesulfonamide
CID 102703815
methyl 3-[(5-pyrrolidin-2-yl-1,3,4-oxadiazol-2-yl)sulfamoyl]propanoate
CID 102703727
2-methylsulfanyl-N-(5-pyrrolidin-2-yl-1,3,4-oxadiazol-2-yl)acetamide
CID 102703433
N-cyclopropyl-5-piperidin-2-yl-1,3,4-oxadiazol-2-amine
CID 110456032
N-cyclopropyl-4-methyl-2-oxo-3H-1,3-thiazole-5-sulfonamide
CID 60723887
2,2-dimethyl-N-(5-pyrrolidin-2-yl-1,3,4-oxadiazol-2-yl)butanamide
CID 102703341
1,3,5-trimethyl-N-(5-pyrrolidin-2-yl-1,3,4-oxadiazol-2-yl)pyrazole-4-carboxamide
CID 102703303
5-methyl-N-(5-pyrrolidin-2-yl-1,3,4-oxadiazol-2-yl)-1H-pyrazole-4-carboxamide
CID 102703332
4-methyl-2-oxo-N-(thian-2-ylmethyl)-3H-1,3-thiazole-5-sulfonamide
CID 80613260
1-ethyl-3-(5-pyrrolidin-2-yl-1,3,4-oxadiazol-2-yl)urea
CID 102703600

Frequently Asked Questions

What is the IUPAC name of 4-methyl-2-oxo-N-(5-pyrrolidin-2-yl-1,3,4-oxadiazol-2-yl)-3H-1,3-thiazole-5-sulfonamide?
The IUPAC name of 4-methyl-2-oxo-N-(5-pyrrolidin-2-yl-1,3,4-oxadiazol-2-yl)-3H-1,3-thiazole-5-sulfonamide (CID 102703654) is 4-methyl-2-oxo-N-(5-pyrrolidin-2-yl-1,3,4-oxadiazol-2-yl)-3H-1,3-thiazole-5-sulfonamide.
What is the SMILES notation for 4-methyl-2-oxo-N-(5-pyrrolidin-2-yl-1,3,4-oxadiazol-2-yl)-3H-1,3-thiazole-5-sulfonamide?
The canonical SMILES for 4-methyl-2-oxo-N-(5-pyrrolidin-2-yl-1,3,4-oxadiazol-2-yl)-3H-1,3-thiazole-5-sulfonamide is Cc1[nH]c(=O)sc1S(=O)(=O)Nc1nnc(C2CCCN2)o1.
What is the InChIKey of 4-methyl-2-oxo-N-(5-pyrrolidin-2-yl-1,3,4-oxadiazol-2-yl)-3H-1,3-thiazole-5-sulfonamide?
The InChIKey is RZUDDJLGWGASPM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13N5O4S2/c1-5-8(20-10(16)12-5)21(17,18)15-9-14-13-7(19-9)6-3-2-4-11-6/h6,11H,2-4H2,1H3,(H,12,16)(H,14,15).
What are the key properties of 4-methyl-2-oxo-N-(5-pyrrolidin-2-yl-1,3,4-oxadiazol-2-yl)-3H-1,3-thiazole-5-sulfonamide?
4-methyl-2-oxo-N-(5-pyrrolidin-2-yl-1,3,4-oxadiazol-2-yl)-3H-1,3-thiazole-5-sulfonamide has a molecular weight of 331.38 g/mol, XLogP of 0.35, 4 rotatable bonds, 3 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-2-oxo-N-(5-pyrrolidin-2-yl-1,3,4-oxadiazol-2-yl)-3H-1,3-thiazole-5-sulfonamide is sourced from PubChem (CID 102703654), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).