N-(2-aminopropyl)-5-methylthiophene-2-sulfonamide

C8H14N2O2S2 — CID 63732116

IUPACN-(2-aminopropyl)-5-methylthiophene-2-sulfonamide
SMILESCc1ccc(S(=O)(=O)NCC(C)N)s1
InChIInChI=1S/C8H14N2O2S2/c1-6(9)5-10-14(11,12)8-4-3-7(2)13-8/h3-4,6,10H,5,9H2,1-2H3
InChIKeyZFNGOARVROJUHS-UHFFFAOYSA-N
MW234.35 g/mol
LogP0.68
Rot. Bonds4

About N-(2-aminopropyl)-5-methylthiophene-2-sulfonamide

N-(2-aminopropyl)-5-methylthiophene-2-sulfonamide (PubChem CID 63732116) has the molecular formula C8H14N2O2S2 and a molecular weight of 234.35 g/mol. Its IUPAC name is N-(2-aminopropyl)-5-methylthiophene-2-sulfonamide.

Molecular Properties

Compound NameN-(2-aminopropyl)-5-methylthiophene-2-sulfonamide
PubChem CID63732116
Molecular FormulaC8H14N2O2S2
Molecular Weight234.35 g/mol
Exact Mass234.05
IUPAC NameN-(2-aminopropyl)-5-methylthiophene-2-sulfonamide
SMILESCc1ccc(S(=O)(=O)NCC(C)N)s1
InChIInChI=1S/C8H14N2O2S2/c1-6(9)5-10-14(11,12)8-4-3-7(2)13-8/h3-4,6,10H,5,9H2,1-2H3
InChIKeyZFNGOARVROJUHS-UHFFFAOYSA-N
XLogP0.68
TPSA72.19 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.35
LogP ≤ 50.68
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2-aminobutyl)-5-methylthiophene-2-sulfonamide
CID 63733262
5-methyl-N-[2-(methylamino)propyl]thiophene-2-sulfonamide
CID 120825500
N-[(2S)-2-aminopentyl]-5-methylthiophene-2-sulfonamide
CID 97238647
N-[(2R)-2-aminopentyl]-5-methylthiophene-2-sulfonamide
CID 97238648
5-methyl-N-(2-phenylpropyl)thiophene-2-sulfonamide
CID 47109865
3-methyl-2-[[(5-methylthiophen-2-yl)sulfonylamino]methyl]butanoic acid
CID 65221421
N-ethyl-5-methylthiophene-2-sulfonamide
CID 43212959
N-(2-hydroxy-2-phenylethyl)-5-methylthiophene-2-sulfonamide
CID 43502482
5-methyl-N-(2-methyl-3-pyrazol-1-ylpropyl)thiophene-2-sulfonamide
CID 55735458
5-methyl-N-[3-methyl-2-(4-methylpiperazin-1-yl)butyl]thiophene-2-sulfonamide
CID 56685915
N-(2-hydroxy-2-thiophen-2-ylethyl)-5-methylthiophene-2-sulfonamide
CID 90500280
5-methyl-N-(3-sulfamoylpropyl)thiophene-2-sulfonamide
CID 61132568

Frequently Asked Questions

What is the IUPAC name of N-(2-aminopropyl)-5-methylthiophene-2-sulfonamide?
The IUPAC name of N-(2-aminopropyl)-5-methylthiophene-2-sulfonamide (CID 63732116) is N-(2-aminopropyl)-5-methylthiophene-2-sulfonamide.
What is the SMILES notation for N-(2-aminopropyl)-5-methylthiophene-2-sulfonamide?
The canonical SMILES for N-(2-aminopropyl)-5-methylthiophene-2-sulfonamide is Cc1ccc(S(=O)(=O)NCC(C)N)s1.
What is the InChIKey of N-(2-aminopropyl)-5-methylthiophene-2-sulfonamide?
The InChIKey is ZFNGOARVROJUHS-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14N2O2S2/c1-6(9)5-10-14(11,12)8-4-3-7(2)13-8/h3-4,6,10H,5,9H2,1-2H3.
What are the key properties of N-(2-aminopropyl)-5-methylthiophene-2-sulfonamide?
N-(2-aminopropyl)-5-methylthiophene-2-sulfonamide has a molecular weight of 234.35 g/mol, XLogP of 0.68, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-aminopropyl)-5-methylthiophene-2-sulfonamide is sourced from PubChem (CID 63732116), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).