N-cyclopropyl-4-methyl-2-oxo-3H-1,3-thiazole-5-sulfonamide

C7H10N2O3S2 — CID 60723887

IUPACN-cyclopropyl-4-methyl-2-oxo-3H-1,3-thiazole-5-sulfonamide
SMILESCc1[nH]c(=O)sc1S(=O)(=O)NC1CC1
InChIInChI=1S/C7H10N2O3S2/c1-4-6(13-7(10)8-4)14(11,12)9-5-2-3-5/h5,9H,2-3H2,1H3,(H,8,10)
InChIKeyZXIOQTFCWUWOAD-UHFFFAOYSA-N
MW234.30 g/mol
LogP0.19
Rot. Bonds3

About N-cyclopropyl-4-methyl-2-oxo-3H-1,3-thiazole-5-sulfonamide

N-cyclopropyl-4-methyl-2-oxo-3H-1,3-thiazole-5-sulfonamide (PubChem CID 60723887) has the molecular formula C7H10N2O3S2 and a molecular weight of 234.30 g/mol. Its IUPAC name is N-cyclopropyl-4-methyl-2-oxo-3H-1,3-thiazole-5-sulfonamide.

Molecular Properties

Compound NameN-cyclopropyl-4-methyl-2-oxo-3H-1,3-thiazole-5-sulfonamide
PubChem CID60723887
Molecular FormulaC7H10N2O3S2
Molecular Weight234.30 g/mol
Exact Mass234.01
IUPAC NameN-cyclopropyl-4-methyl-2-oxo-3H-1,3-thiazole-5-sulfonamide
SMILESCc1[nH]c(=O)sc1S(=O)(=O)NC1CC1
InChIInChI=1S/C7H10N2O3S2/c1-4-6(13-7(10)8-4)14(11,12)9-5-2-3-5/h5,9H,2-3H2,1H3,(H,8,10)
InChIKeyZXIOQTFCWUWOAD-UHFFFAOYSA-N
XLogP0.19
TPSA79.03 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.30
LogP ≤ 50.19
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-4-methyl-2-oxo-3H-1,3-thiazole-5-sulfonamide?
The IUPAC name of N-cyclopropyl-4-methyl-2-oxo-3H-1,3-thiazole-5-sulfonamide (CID 60723887) is N-cyclopropyl-4-methyl-2-oxo-3H-1,3-thiazole-5-sulfonamide.
What is the SMILES notation for N-cyclopropyl-4-methyl-2-oxo-3H-1,3-thiazole-5-sulfonamide?
The canonical SMILES for N-cyclopropyl-4-methyl-2-oxo-3H-1,3-thiazole-5-sulfonamide is Cc1[nH]c(=O)sc1S(=O)(=O)NC1CC1.
What is the InChIKey of N-cyclopropyl-4-methyl-2-oxo-3H-1,3-thiazole-5-sulfonamide?
The InChIKey is ZXIOQTFCWUWOAD-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H10N2O3S2/c1-4-6(13-7(10)8-4)14(11,12)9-5-2-3-5/h5,9H,2-3H2,1H3,(H,8,10).
What are the key properties of N-cyclopropyl-4-methyl-2-oxo-3H-1,3-thiazole-5-sulfonamide?
N-cyclopropyl-4-methyl-2-oxo-3H-1,3-thiazole-5-sulfonamide has a molecular weight of 234.30 g/mol, XLogP of 0.19, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-4-methyl-2-oxo-3H-1,3-thiazole-5-sulfonamide is sourced from PubChem (CID 60723887), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).