N-propan-2-yl-N-(thiophen-2-ylmethyl)propane-2-sulfonamide

C11H19NO2S2 — CID 61395279

IUPACN-propan-2-yl-N-(thiophen-2-ylmethyl)propane-2-sulfonamide
SMILESCC(C)N(Cc1cccs1)S(=O)(=O)C(C)C
InChIInChI=1S/C11H19NO2S2/c1-9(2)12(16(13,14)10(3)4)8-11-6-5-7-15-11/h5-7,9-10H,8H2,1-4H3
InChIKeyLJZSQRJJPZLWQG-UHFFFAOYSA-N
MW261.41 g/mol
LogP2.70
Rot. Bonds5

About N-propan-2-yl-N-(thiophen-2-ylmethyl)propane-2-sulfonamide

N-propan-2-yl-N-(thiophen-2-ylmethyl)propane-2-sulfonamide (PubChem CID 61395279) has the molecular formula C11H19NO2S2 and a molecular weight of 261.41 g/mol. Its IUPAC name is N-propan-2-yl-N-(thiophen-2-ylmethyl)propane-2-sulfonamide.

Molecular Properties

Compound NameN-propan-2-yl-N-(thiophen-2-ylmethyl)propane-2-sulfonamide
PubChem CID61395279
Molecular FormulaC11H19NO2S2
Molecular Weight261.41 g/mol
Exact Mass261.09
IUPAC NameN-propan-2-yl-N-(thiophen-2-ylmethyl)propane-2-sulfonamide
SMILESCC(C)N(Cc1cccs1)S(=O)(=O)C(C)C
InChIInChI=1S/C11H19NO2S2/c1-9(2)12(16(13,14)10(3)4)8-11-6-5-7-15-11/h5-7,9-10H,8H2,1-4H3
InChIKeyLJZSQRJJPZLWQG-UHFFFAOYSA-N
XLogP2.70
TPSA37.38 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.41
LogP ≤ 52.70
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze N-propan-2-yl-N-(thiophen-2-ylmethyl)propane-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

methyl 4-[propan-2-yl(thiophen-2-ylmethyl)sulfamoyl]butanoate
CID 61460631
3-amino-5-methyl-N-propan-2-yl-N-(thiophen-2-ylmethyl)benzenesulfonamide
CID 61450031
4-methyl-2-oxo-N-propan-2-yl-N-(thiophen-2-ylmethyl)-3H-1,3-thiazole-5-sulfonamide
CID 61455518
2-[methyl(thiophen-2-ylmethyl)sulfamoyl]propanoic acid
CID 61454199
2-chloro-N-propan-2-yl-N-(thiophen-2-ylmethyl)pyridine-4-sulfonamide
CID 61452159
2-amino-4-bromo-N-propan-2-yl-N-(thiophen-2-ylmethyl)benzenesulfonamide
CID 61450114
5-[propan-2-yl(thiophen-2-ylmethyl)sulfamoyl]-1H-pyrazole-3-carboxylic acid
CID 166390232
2-[[sulfamoyl(thiophen-2-ylmethyl)amino]methyl]thiophene
CID 112684189
(2S)-1-[propan-2-yl(thiophen-2-ylmethyl)amino]propan-2-ol
CID 106932766
N-ethyl-N-(thiophen-2-ylmethyl)methanesulfonamide
CID 60681457
1,1-dimethyl-3-propan-2-yl-3-(thiophen-2-ylmethyl)urea
CID 115591362
2-chloro-N-propan-2-yl-N-(thiophen-2-ylmethyl)acetamide
CID 39248066

Frequently Asked Questions

What is the IUPAC name of N-propan-2-yl-N-(thiophen-2-ylmethyl)propane-2-sulfonamide?
The IUPAC name of N-propan-2-yl-N-(thiophen-2-ylmethyl)propane-2-sulfonamide (CID 61395279) is N-propan-2-yl-N-(thiophen-2-ylmethyl)propane-2-sulfonamide.
What is the SMILES notation for N-propan-2-yl-N-(thiophen-2-ylmethyl)propane-2-sulfonamide?
The canonical SMILES for N-propan-2-yl-N-(thiophen-2-ylmethyl)propane-2-sulfonamide is CC(C)N(Cc1cccs1)S(=O)(=O)C(C)C.
What is the InChIKey of N-propan-2-yl-N-(thiophen-2-ylmethyl)propane-2-sulfonamide?
The InChIKey is LJZSQRJJPZLWQG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19NO2S2/c1-9(2)12(16(13,14)10(3)4)8-11-6-5-7-15-11/h5-7,9-10H,8H2,1-4H3.
What are the key properties of N-propan-2-yl-N-(thiophen-2-ylmethyl)propane-2-sulfonamide?
N-propan-2-yl-N-(thiophen-2-ylmethyl)propane-2-sulfonamide has a molecular weight of 261.41 g/mol, XLogP of 2.70, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-propan-2-yl-N-(thiophen-2-ylmethyl)propane-2-sulfonamide is sourced from PubChem (CID 61395279), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).