N-(azetidin-3-yl)-N-ethyl-2,5-dimethylthiophene-3-sulfonamide

C11H18N2O2S2 — CID 66181491

IUPACN-(azetidin-3-yl)-N-ethyl-2,5-dimethylthiophene-3-sulfonamide
SMILESCCN(C1CNC1)S(=O)(=O)c1cc(C)sc1C
InChIInChI=1S/C11H18N2O2S2/c1-4-13(10-6-12-7-10)17(14,15)11-5-8(2)16-9(11)3/h5,10,12H,4,6-7H2,1-3H3
InChIKeyHVOVPGINDPQHOA-UHFFFAOYSA-N
MW274.41 g/mol
LogP1.35
Rot. Bonds4

About N-(azetidin-3-yl)-N-ethyl-2,5-dimethylthiophene-3-sulfonamide

N-(azetidin-3-yl)-N-ethyl-2,5-dimethylthiophene-3-sulfonamide (PubChem CID 66181491) has the molecular formula C11H18N2O2S2 and a molecular weight of 274.41 g/mol. Its IUPAC name is N-(azetidin-3-yl)-N-ethyl-2,5-dimethylthiophene-3-sulfonamide.

Molecular Properties

Compound NameN-(azetidin-3-yl)-N-ethyl-2,5-dimethylthiophene-3-sulfonamide
PubChem CID66181491
Molecular FormulaC11H18N2O2S2
Molecular Weight274.41 g/mol
Exact Mass274.08
IUPAC NameN-(azetidin-3-yl)-N-ethyl-2,5-dimethylthiophene-3-sulfonamide
SMILESCCN(C1CNC1)S(=O)(=O)c1cc(C)sc1C
InChIInChI=1S/C11H18N2O2S2/c1-4-13(10-6-12-7-10)17(14,15)11-5-8(2)16-9(11)3/h5,10,12H,4,6-7H2,1-3H3
InChIKeyHVOVPGINDPQHOA-UHFFFAOYSA-N
XLogP1.35
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.41
LogP ≤ 51.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-(azetidin-3-yl)-N-ethyl-2,5-dimethylthiophene-3-sulfonamide 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

N-(8-azabicyclo[3.2.1]octan-3-yl)-N-ethyl-2,5-dimethylthiophene-3-sulfonamide
CID 61232487
N-[(3S)-1,1-dioxothiolan-3-yl]-N-ethyl-2,5-dimethylthiophene-3-sulfonamide
CID 94186742
methyl 4-[azetidin-3-yl(ethyl)sulfamoyl]-5-bromothiophene-2-carboxylate
CID 66182989
5-(2,5-dimethylthiophen-3-yl)sulfonyl-2,3,3a,4,6,6a-hexahydro-1H-pyrrolo[3,4-c]pyrrole
CID 66210855
N-(azetidin-3-yl)-N-ethyl-2,5-dimethoxybenzenesulfonamide
CID 66181481
N-(azetidin-3-yl)-N-ethyl-2-fluoro-5-methylsulfonylbenzenesulfonamide
CID 66183403
N-(azetidin-3-yl)-N-ethyl-4-methylsulfonylbenzenesulfonamide
CID 66184477
N-(azetidin-3-yl)-N-ethyl-4-iodobenzenesulfonamide
CID 66183635
N-(azetidin-3-yl)-2-chloro-N-ethyl-5-(trifluoromethyl)benzenesulfonamide
CID 66184263
N-(azepan-4-yl)-N,2,5-trimethylthiophene-3-sulfonamide
CID 107173135
2,5-dimethyl-N-(piperidin-4-ylmethyl)-N-propylthiophene-3-sulfonamide
CID 79701384
N-(azetidin-3-yl)-3-chloro-N-ethyl-2-fluorobenzenesulfonamide
CID 66182987

Frequently Asked Questions

What is the IUPAC name of N-(azetidin-3-yl)-N-ethyl-2,5-dimethylthiophene-3-sulfonamide?
The IUPAC name of N-(azetidin-3-yl)-N-ethyl-2,5-dimethylthiophene-3-sulfonamide (CID 66181491) is N-(azetidin-3-yl)-N-ethyl-2,5-dimethylthiophene-3-sulfonamide.
What is the SMILES notation for N-(azetidin-3-yl)-N-ethyl-2,5-dimethylthiophene-3-sulfonamide?
The canonical SMILES for N-(azetidin-3-yl)-N-ethyl-2,5-dimethylthiophene-3-sulfonamide is CCN(C1CNC1)S(=O)(=O)c1cc(C)sc1C.
What is the InChIKey of N-(azetidin-3-yl)-N-ethyl-2,5-dimethylthiophene-3-sulfonamide?
The InChIKey is HVOVPGINDPQHOA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N2O2S2/c1-4-13(10-6-12-7-10)17(14,15)11-5-8(2)16-9(11)3/h5,10,12H,4,6-7H2,1-3H3.
What are the key properties of N-(azetidin-3-yl)-N-ethyl-2,5-dimethylthiophene-3-sulfonamide?
N-(azetidin-3-yl)-N-ethyl-2,5-dimethylthiophene-3-sulfonamide has a molecular weight of 274.41 g/mol, XLogP of 1.35, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(azetidin-3-yl)-N-ethyl-2,5-dimethylthiophene-3-sulfonamide is sourced from PubChem (CID 66181491), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).