5-(2-aminoethyl)-N-(1-phenylethyl)thiophene-2-sulfonamide

C14H18N2O2S2 — CID 43520782

IUPAC5-(2-aminoethyl)-N-(1-phenylethyl)thiophene-2-sulfonamide
SMILESCC(NS(=O)(=O)c1ccc(CCN)s1)c1ccccc1
InChIInChI=1S/C14H18N2O2S2/c1-11(12-5-3-2-4-6-12)16-20(17,18)14-8-7-13(19-14)9-10-15/h2-8,11,16H,9-10,15H2,1H3
InChIKeySHZGAZBGFQXDNM-UHFFFAOYSA-N
MW310.44 g/mol
LogP2.29
Rot. Bonds6

About 5-(2-aminoethyl)-N-(1-phenylethyl)thiophene-2-sulfonamide

5-(2-aminoethyl)-N-(1-phenylethyl)thiophene-2-sulfonamide (PubChem CID 43520782) has the molecular formula C14H18N2O2S2 and a molecular weight of 310.44 g/mol. Its IUPAC name is 5-(2-aminoethyl)-N-(1-phenylethyl)thiophene-2-sulfonamide.

Molecular Properties

Compound Name5-(2-aminoethyl)-N-(1-phenylethyl)thiophene-2-sulfonamide
PubChem CID43520782
Molecular FormulaC14H18N2O2S2
Molecular Weight310.44 g/mol
Exact Mass310.08
IUPAC Name5-(2-aminoethyl)-N-(1-phenylethyl)thiophene-2-sulfonamide
SMILESCC(NS(=O)(=O)c1ccc(CCN)s1)c1ccccc1
InChIInChI=1S/C14H18N2O2S2/c1-11(12-5-3-2-4-6-12)16-20(17,18)14-8-7-13(19-14)9-10-15/h2-8,11,16H,9-10,15H2,1H3
InChIKeySHZGAZBGFQXDNM-UHFFFAOYSA-N
XLogP2.29
TPSA72.19 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.44
LogP ≤ 52.29
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-[5-(1-phenylethylsulfamoyl)thiophen-2-yl]acetic acid
CID 43079020
5-(2-aminoethyl)-N-[1-(1H-1,2,4-triazol-5-yl)ethyl]thiophene-2-sulfonamide
CID 106283146
5-(2-aminoethyl)-N-phenylthiophene-2-sulfonamide
CID 43520785
5-(2-aminoethyl)-N-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]thiophene-2-sulfonamide
CID 106388977
5-[[(1R)-1-phenylethyl]sulfamoyl]thiophene-2-carboxylic acid
CID 63867055
N-[[5-[1-(4-phenylphenyl)ethylsulfamoyl]thiophen-2-yl]methyl]acetamide
CID 42918243
5-cyano-N-[(1R)-1-phenylethyl]thiophene-2-sulfonamide
CID 106269624
5-(2-aminoethyl)-N-(1-pyrazol-1-ylpropan-2-yl)thiophene-2-sulfonamide
CID 61461194
5-(aminomethyl)-N-[1-(furan-2-yl)ethyl]thiophene-2-sulfonamide
CID 43535864
5-(2-hydroxyethyl)-N-[1-(1H-pyrazol-4-yl)ethyl]thiophene-2-sulfonamide
CID 106218355
5-(2-aminoethyl)-N-(2,6-dibromophenyl)thiophene-2-sulfonamide
CID 107601110
5-(2-aminoethyl)-N-(3-methylsulfanylbutyl)thiophene-2-sulfonamide
CID 113494086

Frequently Asked Questions

What is the IUPAC name of 5-(2-aminoethyl)-N-(1-phenylethyl)thiophene-2-sulfonamide?
The IUPAC name of 5-(2-aminoethyl)-N-(1-phenylethyl)thiophene-2-sulfonamide (CID 43520782) is 5-(2-aminoethyl)-N-(1-phenylethyl)thiophene-2-sulfonamide.
What is the SMILES notation for 5-(2-aminoethyl)-N-(1-phenylethyl)thiophene-2-sulfonamide?
The canonical SMILES for 5-(2-aminoethyl)-N-(1-phenylethyl)thiophene-2-sulfonamide is CC(NS(=O)(=O)c1ccc(CCN)s1)c1ccccc1.
What is the InChIKey of 5-(2-aminoethyl)-N-(1-phenylethyl)thiophene-2-sulfonamide?
The InChIKey is SHZGAZBGFQXDNM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N2O2S2/c1-11(12-5-3-2-4-6-12)16-20(17,18)14-8-7-13(19-14)9-10-15/h2-8,11,16H,9-10,15H2,1H3.
What are the key properties of 5-(2-aminoethyl)-N-(1-phenylethyl)thiophene-2-sulfonamide?
5-(2-aminoethyl)-N-(1-phenylethyl)thiophene-2-sulfonamide has a molecular weight of 310.44 g/mol, XLogP of 2.29, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-aminoethyl)-N-(1-phenylethyl)thiophene-2-sulfonamide is sourced from PubChem (CID 43520782), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).