N-(2-aminocyclopropyl)-4-methyl-2-oxo-3H-1,3-thiazole-5-sulfonamide

C7H11N3O3S2 — CID 43596929

IUPACN-(2-aminocyclopropyl)-4-methyl-2-oxo-3H-1,3-thiazole-5-sulfonamide
SMILESCc1[nH]c(=O)sc1S(=O)(=O)NC1CC1N
InChIInChI=1S/C7H11N3O3S2/c1-3-6(14-7(11)9-3)15(12,13)10-5-2-4(5)8/h4-5,10H,2,8H2,1H3,(H,9,11)
InChIKeyRZTXASBSEYPQRR-UHFFFAOYSA-N
MW249.32 g/mol
LogP-0.88
Rot. Bonds3

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

N-(2-aminocyclopropyl)-4-methyl-2-oxo-3H-1,3-thiazole-5-sulfonamide (PubChem CID 43596929) has the molecular formula C7H11N3O3S2 and a molecular weight of 249.32 g/mol. Its IUPAC name is N-(2-aminocyclopropyl)-4-methyl-2-oxo-3H-1,3-thiazole-5-sulfonamide.

Molecular Properties

Compound NameN-(2-aminocyclopropyl)-4-methyl-2-oxo-3H-1,3-thiazole-5-sulfonamide
PubChem CID43596929
Molecular FormulaC7H11N3O3S2
Molecular Weight249.32 g/mol
Exact Mass249.02
IUPAC NameN-(2-aminocyclopropyl)-4-methyl-2-oxo-3H-1,3-thiazole-5-sulfonamide
SMILESCc1[nH]c(=O)sc1S(=O)(=O)NC1CC1N
InChIInChI=1S/C7H11N3O3S2/c1-3-6(14-7(11)9-3)15(12,13)10-5-2-4(5)8/h4-5,10H,2,8H2,1H3,(H,9,11)
InChIKeyRZTXASBSEYPQRR-UHFFFAOYSA-N
XLogP-0.88
TPSA105.05 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.32
LogP ≤ 5-0.88
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-(2-aminocyclopropyl)-4-methyl-2-oxo-3H-1,3-thiazole-5-sulfonamide?
The IUPAC name of N-(2-aminocyclopropyl)-4-methyl-2-oxo-3H-1,3-thiazole-5-sulfonamide (CID 43596929) is N-(2-aminocyclopropyl)-4-methyl-2-oxo-3H-1,3-thiazole-5-sulfonamide.
What is the SMILES notation for N-(2-aminocyclopropyl)-4-methyl-2-oxo-3H-1,3-thiazole-5-sulfonamide?
The canonical SMILES for N-(2-aminocyclopropyl)-4-methyl-2-oxo-3H-1,3-thiazole-5-sulfonamide is Cc1[nH]c(=O)sc1S(=O)(=O)NC1CC1N.
What is the InChIKey of N-(2-aminocyclopropyl)-4-methyl-2-oxo-3H-1,3-thiazole-5-sulfonamide?
The InChIKey is RZTXASBSEYPQRR-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H11N3O3S2/c1-3-6(14-7(11)9-3)15(12,13)10-5-2-4(5)8/h4-5,10H,2,8H2,1H3,(H,9,11).
What are the key properties of N-(2-aminocyclopropyl)-4-methyl-2-oxo-3H-1,3-thiazole-5-sulfonamide?
N-(2-aminocyclopropyl)-4-methyl-2-oxo-3H-1,3-thiazole-5-sulfonamide has a molecular weight of 249.32 g/mol, XLogP of -0.88, 3 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-aminocyclopropyl)-4-methyl-2-oxo-3H-1,3-thiazole-5-sulfonamide is sourced from PubChem (CID 43596929), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).