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

C15H19NO2S2 — CID 79477673

IUPAC2-methyl-N-(2-methyl-2-thiophen-2-ylpropyl)benzenesulfonamide
SMILESCc1ccccc1S(=O)(=O)NCC(C)(C)c1cccs1
InChIInChI=1S/C15H19NO2S2/c1-12-7-4-5-8-13(12)20(17,18)16-11-15(2,3)14-9-6-10-19-14/h4-10,16H,11H2,1-3H3
InChIKeyPVJFGEVAKHXCGD-UHFFFAOYSA-N
MW309.46 g/mol
LogP3.31
Rot. Bonds5

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

2-methyl-N-(2-methyl-2-thiophen-2-ylpropyl)benzenesulfonamide (PubChem CID 79477673) has the molecular formula C15H19NO2S2 and a molecular weight of 309.46 g/mol. Its IUPAC name is 2-methyl-N-(2-methyl-2-thiophen-2-ylpropyl)benzenesulfonamide.

Molecular Properties

Compound Name2-methyl-N-(2-methyl-2-thiophen-2-ylpropyl)benzenesulfonamide
PubChem CID79477673
Molecular FormulaC15H19NO2S2
Molecular Weight309.46 g/mol
Exact Mass309.09
IUPAC Name2-methyl-N-(2-methyl-2-thiophen-2-ylpropyl)benzenesulfonamide
SMILESCc1ccccc1S(=O)(=O)NCC(C)(C)c1cccs1
InChIInChI=1S/C15H19NO2S2/c1-12-7-4-5-8-13(12)20(17,18)16-11-15(2,3)14-9-6-10-19-14/h4-10,16H,11H2,1-3H3
InChIKeyPVJFGEVAKHXCGD-UHFFFAOYSA-N
XLogP3.31
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.46
LogP ≤ 53.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-amino-6-methyl-N-(2-methyl-2-thiophen-2-ylpropyl)benzenesulfonamide
CID 80526302
2-amino-4-methyl-N-(2-methyl-2-thiophen-2-ylpropyl)benzenesulfonamide
CID 80526301
2-(aminomethyl)-N-(2-methyl-2-thiophen-2-ylpropyl)thiophene-3-sulfonamide
CID 106072628
2-(methylamino)-N-(2-methyl-2-thiophen-2-ylpropyl)pyridine-3-sulfonamide
CID 80524392
N-(3-bromo-2,2-dimethylpropyl)-2-methylbenzenesulfonamide
CID 115365244
4-(aminomethyl)-N-(2-methyl-2-thiophen-2-ylpropyl)benzenesulfonamide
CID 80522231
4-methoxy-N-(2-methyl-2-thiophen-2-ylpropyl)benzenesulfonamide
CID 110731451
4-bromo-2-chloro-N-(2-methyl-2-thiophen-2-ylpropyl)benzenesulfonamide
CID 80524040
2-methyl-N-(2-methyl-2-methylsulfonylpropyl)benzenesulfonamide
CID 79556754
6-hydrazinyl-N-(2-methyl-2-thiophen-2-ylpropyl)pyridine-3-sulfonamide
CID 80522758
3-methyl-N-(2-methyl-2-thiophen-2-ylpropyl)pyridin-2-amine
CID 80528214
1-(3-aminophenyl)-N-(2-methyl-2-thiophen-2-ylpropyl)methanesulfonamide
CID 80526318

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-(2-methyl-2-thiophen-2-ylpropyl)benzenesulfonamide?
The IUPAC name of 2-methyl-N-(2-methyl-2-thiophen-2-ylpropyl)benzenesulfonamide (CID 79477673) is 2-methyl-N-(2-methyl-2-thiophen-2-ylpropyl)benzenesulfonamide.
What is the SMILES notation for 2-methyl-N-(2-methyl-2-thiophen-2-ylpropyl)benzenesulfonamide?
The canonical SMILES for 2-methyl-N-(2-methyl-2-thiophen-2-ylpropyl)benzenesulfonamide is Cc1ccccc1S(=O)(=O)NCC(C)(C)c1cccs1.
What is the InChIKey of 2-methyl-N-(2-methyl-2-thiophen-2-ylpropyl)benzenesulfonamide?
The InChIKey is PVJFGEVAKHXCGD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19NO2S2/c1-12-7-4-5-8-13(12)20(17,18)16-11-15(2,3)14-9-6-10-19-14/h4-10,16H,11H2,1-3H3.
What are the key properties of 2-methyl-N-(2-methyl-2-thiophen-2-ylpropyl)benzenesulfonamide?
2-methyl-N-(2-methyl-2-thiophen-2-ylpropyl)benzenesulfonamide has a molecular weight of 309.46 g/mol, XLogP of 3.31, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-(2-methyl-2-thiophen-2-ylpropyl)benzenesulfonamide is sourced from PubChem (CID 79477673), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).