N-methyl-2-(thiophen-2-ylmethylamino)benzenesulfonamide

C12H14N2O2S2 — CID 43383430

IUPACN-methyl-2-(thiophen-2-ylmethylamino)benzenesulfonamide
SMILESCNS(=O)(=O)c1ccccc1NCc1cccs1
InChIInChI=1S/C12H14N2O2S2/c1-13-18(15,16)12-7-3-2-6-11(12)14-9-10-5-4-8-17-10/h2-8,13-14H,9H2,1H3
InChIKeyGSDCTTLWMSQAKL-UHFFFAOYSA-N
MW282.39 g/mol
LogP2.27
Rot. Bonds5

About N-methyl-2-(thiophen-2-ylmethylamino)benzenesulfonamide

N-methyl-2-(thiophen-2-ylmethylamino)benzenesulfonamide (PubChem CID 43383430) has the molecular formula C12H14N2O2S2 and a molecular weight of 282.39 g/mol. Its IUPAC name is N-methyl-2-(thiophen-2-ylmethylamino)benzenesulfonamide.

Molecular Properties

Compound NameN-methyl-2-(thiophen-2-ylmethylamino)benzenesulfonamide
PubChem CID43383430
Molecular FormulaC12H14N2O2S2
Molecular Weight282.39 g/mol
Exact Mass282.05
IUPAC NameN-methyl-2-(thiophen-2-ylmethylamino)benzenesulfonamide
SMILESCNS(=O)(=O)c1ccccc1NCc1cccs1
InChIInChI=1S/C12H14N2O2S2/c1-13-18(15,16)12-7-3-2-6-11(12)14-9-10-5-4-8-17-10/h2-8,13-14H,9H2,1H3
InChIKeyGSDCTTLWMSQAKL-UHFFFAOYSA-N
XLogP2.27
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.39
LogP ≤ 52.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-(ethylamino)-N-(thiophen-2-ylmethyl)benzenesulfonamide
CID 62143225
2-[(4,5-dimethylthiophen-2-yl)methylamino]-N-methylbenzenesulfonamide
CID 65245869
2-[(4-cyanothiophen-2-yl)methylamino]-N-methylbenzenesulfonamide
CID 79614705
2-(5,6-dihydro-4H-cyclopenta[b]thiophen-2-ylmethylamino)-N-methylbenzenesulfonamide
CID 61208189
2-(thiophen-2-ylmethylamino)benzamide
CID 83291253
N-methyl-2-[[5-(methylsulfanylmethyl)furan-2-yl]methylamino]benzenesulfonamide
CID 43792036
2-(3,3-dimethylbutylamino)-N-methylbenzenesulfonamide
CID 62951903
2-(2,2-difluoroethylamino)-N-methylbenzenesulfonamide
CID 115407635
2-[(2-methoxy-3-pyridinyl)methylamino]-N-methylbenzenesulfonamide
CID 60859341
2-(2,3-dimethylbutylamino)-N-methylbenzenesulfonamide
CID 64596946
2-(2-methoxyethylamino)-N-methylbenzenesulfonamide
CID 43454289
N-methyl-2-[(6-methyl-3-pyridinyl)methylamino]benzenesulfonamide
CID 62994869

Frequently Asked Questions

What is the IUPAC name of N-methyl-2-(thiophen-2-ylmethylamino)benzenesulfonamide?
The IUPAC name of N-methyl-2-(thiophen-2-ylmethylamino)benzenesulfonamide (CID 43383430) is N-methyl-2-(thiophen-2-ylmethylamino)benzenesulfonamide.
What is the SMILES notation for N-methyl-2-(thiophen-2-ylmethylamino)benzenesulfonamide?
The canonical SMILES for N-methyl-2-(thiophen-2-ylmethylamino)benzenesulfonamide is CNS(=O)(=O)c1ccccc1NCc1cccs1.
What is the InChIKey of N-methyl-2-(thiophen-2-ylmethylamino)benzenesulfonamide?
The InChIKey is GSDCTTLWMSQAKL-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N2O2S2/c1-13-18(15,16)12-7-3-2-6-11(12)14-9-10-5-4-8-17-10/h2-8,13-14H,9H2,1H3.
What are the key properties of N-methyl-2-(thiophen-2-ylmethylamino)benzenesulfonamide?
N-methyl-2-(thiophen-2-ylmethylamino)benzenesulfonamide has a molecular weight of 282.39 g/mol, XLogP of 2.27, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-(thiophen-2-ylmethylamino)benzenesulfonamide is sourced from PubChem (CID 43383430), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).