N-methyl-N-(oxan-4-ylmethyl)thiophene-2-sulfonamide

C11H17NO3S2 — CID 91905220

IUPACN-methyl-N-(oxan-4-ylmethyl)thiophene-2-sulfonamide
SMILESCN(CC1CCOCC1)S(=O)(=O)c1cccs1
InChIInChI=1S/C11H17NO3S2/c1-12(9-10-4-6-15-7-5-10)17(13,14)11-3-2-8-16-11/h2-3,8,10H,4-7,9H2,1H3
InChIKeyCSIDPGZAYYONOP-UHFFFAOYSA-N
MW275.39 g/mol
LogP1.80
Rot. Bonds4

About N-methyl-N-(oxan-4-ylmethyl)thiophene-2-sulfonamide

N-methyl-N-(oxan-4-ylmethyl)thiophene-2-sulfonamide (PubChem CID 91905220) has the molecular formula C11H17NO3S2 and a molecular weight of 275.39 g/mol. Its IUPAC name is N-methyl-N-(oxan-4-ylmethyl)thiophene-2-sulfonamide.

Molecular Properties

Compound NameN-methyl-N-(oxan-4-ylmethyl)thiophene-2-sulfonamide
PubChem CID91905220
Molecular FormulaC11H17NO3S2
Molecular Weight275.39 g/mol
Exact Mass275.06
IUPAC NameN-methyl-N-(oxan-4-ylmethyl)thiophene-2-sulfonamide
SMILESCN(CC1CCOCC1)S(=O)(=O)c1cccs1
InChIInChI=1S/C11H17NO3S2/c1-12(9-10-4-6-15-7-5-10)17(13,14)11-3-2-8-16-11/h2-3,8,10H,4-7,9H2,1H3
InChIKeyCSIDPGZAYYONOP-UHFFFAOYSA-N
XLogP1.80
TPSA46.61 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.39
LogP ≤ 51.80
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze N-methyl-N-(oxan-4-ylmethyl)thiophene-2-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

4-methoxy-N-methyl-N-(oxan-4-ylmethyl)benzenesulfonamide
CID 110752470
2-fluoro-N-methyl-N-(oxan-4-ylmethyl)benzenesulfonamide
CID 63713361
N-(oxan-4-yl)-N-(2,2,2-trifluoroethyl)thiophene-2-sulfonamide
CID 90554881
5-bromo-4-chloro-N-methyl-N-(oxan-4-ylmethyl)thiophene-2-sulfonamide
CID 80579973
N-ethyl-N-methylthiophene-2-sulfonamide;hydrochloride
CID 130616398
4-(bromomethyl)-N-methyl-N-(oxan-4-ylmethyl)benzenesulfonamide
CID 65481628
tert-butyl 3-[[methyl(thiophen-2-ylsulfonyl)amino]methyl]pyrrolidine-1-carboxylate
CID 71647811
tert-butyl (3R)-3-[[methyl(thiophen-2-ylsulfonyl)amino]methyl]pyrrolidine-1-carboxylate
CID 97167683
3,4-difluoro-N-methyl-N-(oxan-4-ylmethyl)benzenesulfonamide
CID 91905238
2-amino-N,3,6-trimethyl-N-(oxan-4-ylmethyl)benzenesulfonamide
CID 103171510
2-amino-6-chloro-N-methyl-N-(oxan-4-ylmethyl)benzenesulfonamide
CID 63726437
N-butyl-N-methylthiophene-2-sulfonamide
CID 4992196

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-(oxan-4-ylmethyl)thiophene-2-sulfonamide?
The IUPAC name of N-methyl-N-(oxan-4-ylmethyl)thiophene-2-sulfonamide (CID 91905220) is N-methyl-N-(oxan-4-ylmethyl)thiophene-2-sulfonamide.
What is the SMILES notation for N-methyl-N-(oxan-4-ylmethyl)thiophene-2-sulfonamide?
The canonical SMILES for N-methyl-N-(oxan-4-ylmethyl)thiophene-2-sulfonamide is CN(CC1CCOCC1)S(=O)(=O)c1cccs1.
What is the InChIKey of N-methyl-N-(oxan-4-ylmethyl)thiophene-2-sulfonamide?
The InChIKey is CSIDPGZAYYONOP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17NO3S2/c1-12(9-10-4-6-15-7-5-10)17(13,14)11-3-2-8-16-11/h2-3,8,10H,4-7,9H2,1H3.
What are the key properties of N-methyl-N-(oxan-4-ylmethyl)thiophene-2-sulfonamide?
N-methyl-N-(oxan-4-ylmethyl)thiophene-2-sulfonamide has a molecular weight of 275.39 g/mol, XLogP of 1.80, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-(oxan-4-ylmethyl)thiophene-2-sulfonamide is sourced from PubChem (CID 91905220), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).