N-(1,2-benzothiazol-5-yl)cyclopropanesulfonamide

C10H10N2O2S2 — CID 91662358

IUPACN-(1,2-benzothiazol-5-yl)cyclopropanesulfonamide
SMILESO=S(=O)(Nc1ccc2sncc2c1)C1CC1
InChIInChI=1S/C10H10N2O2S2/c13-16(14,9-2-3-9)12-8-1-4-10-7(5-8)6-11-15-10/h1,4-6,9,12H,2-3H2
InChIKeyFVEONEQOHSTQMJ-UHFFFAOYSA-N
MW254.34 g/mol
LogP2.20
Rot. Bonds3

About N-(1,2-benzothiazol-5-yl)cyclopropanesulfonamide

N-(1,2-benzothiazol-5-yl)cyclopropanesulfonamide (PubChem CID 91662358) has the molecular formula C10H10N2O2S2 and a molecular weight of 254.34 g/mol. Its IUPAC name is N-(1,2-benzothiazol-5-yl)cyclopropanesulfonamide.

Molecular Properties

Compound NameN-(1,2-benzothiazol-5-yl)cyclopropanesulfonamide
PubChem CID91662358
Molecular FormulaC10H10N2O2S2
Molecular Weight254.34 g/mol
Exact Mass254.02
IUPAC NameN-(1,2-benzothiazol-5-yl)cyclopropanesulfonamide
SMILESO=S(=O)(Nc1ccc2sncc2c1)C1CC1
InChIInChI=1S/C10H10N2O2S2/c13-16(14,9-2-3-9)12-8-1-4-10-7(5-8)6-11-15-10/h1,4-6,9,12H,2-3H2
InChIKeyFVEONEQOHSTQMJ-UHFFFAOYSA-N
XLogP2.20
TPSA59.06 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.34
LogP ≤ 52.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-(1,2-benzothiazol-5-yl)cyclopropanesulfonamide with MolForge

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

Launch Full Analysis

Related Compounds

1,2-Benzisothiazol-5-amine
CID 198293
N-(1,2-benzothiazol-5-yl)thiophene-2-sulfonamide
CID 75511045
N-(1,2-benzothiazol-5-yl)-3-(trifluoromethyl)benzenesulfonamide
CID 75511044
N-(1,2-benzothiazol-5-yl)-4-fluorobenzenesulfonamide
CID 99830045
7-Fluoro-1,2-benzothiazol-5-amine
CID 177793108
6-Fluoro-1,2-benzothiazol-5-amine
CID 177793110
3-Methyl-5-[p-toluenesulfonamido]benz[d]isothiazole
CID 596166
4-amino-N-[4-(1,2-thiazol-4-yl)phenyl]benzenesulfonamide
CID 134096611
6-[(Methylideneamino)sulfonylamino]-1,2-benzothiazole
CID 68250625
N-(1,2-benzothiazol-6-yl)ethanesulfonamide
CID 70645019
6-(Dimethylsulfamoylamino)-1,2-benzothiazole
CID 70645043
N-(1,2-benzothiazol-6-yl)methanesulfonamide
CID 70645082

Frequently Asked Questions

What is the IUPAC name of N-(1,2-benzothiazol-5-yl)cyclopropanesulfonamide?
The IUPAC name of N-(1,2-benzothiazol-5-yl)cyclopropanesulfonamide (CID 91662358) is N-(1,2-benzothiazol-5-yl)cyclopropanesulfonamide.
What is the SMILES notation for N-(1,2-benzothiazol-5-yl)cyclopropanesulfonamide?
The canonical SMILES for N-(1,2-benzothiazol-5-yl)cyclopropanesulfonamide is O=S(=O)(Nc1ccc2sncc2c1)C1CC1.
What is the InChIKey of N-(1,2-benzothiazol-5-yl)cyclopropanesulfonamide?
The InChIKey is FVEONEQOHSTQMJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10N2O2S2/c13-16(14,9-2-3-9)12-8-1-4-10-7(5-8)6-11-15-10/h1,4-6,9,12H,2-3H2.
What are the key properties of N-(1,2-benzothiazol-5-yl)cyclopropanesulfonamide?
N-(1,2-benzothiazol-5-yl)cyclopropanesulfonamide has a molecular weight of 254.34 g/mol, XLogP of 2.20, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1,2-benzothiazol-5-yl)cyclopropanesulfonamide is sourced from PubChem (CID 91662358), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).