5-ethyl-N-(2-hydroxy-2-phenylpropyl)thiophene-2-sulfonamide

C15H19NO3S2 — CID 110664046

IUPAC5-ethyl-N-(2-hydroxy-2-phenylpropyl)thiophene-2-sulfonamide
SMILESCCc1ccc(S(=O)(=O)NCC(C)(O)c2ccccc2)s1
InChIInChI=1S/C15H19NO3S2/c1-3-13-9-10-14(20-13)21(18,19)16-11-15(2,17)12-7-5-4-6-8-12/h4-10,16-17H,3,11H2,1-2H3
InChIKeyGZOOZWDXHNVNRS-UHFFFAOYSA-N
MW325.46 g/mol
LogP2.50
Rot. Bonds6

About 5-ethyl-N-(2-hydroxy-2-phenylpropyl)thiophene-2-sulfonamide

5-ethyl-N-(2-hydroxy-2-phenylpropyl)thiophene-2-sulfonamide (PubChem CID 110664046) has the molecular formula C15H19NO3S2 and a molecular weight of 325.46 g/mol. Its IUPAC name is 5-ethyl-N-(2-hydroxy-2-phenylpropyl)thiophene-2-sulfonamide.

Molecular Properties

Compound Name5-ethyl-N-(2-hydroxy-2-phenylpropyl)thiophene-2-sulfonamide
PubChem CID110664046
Molecular FormulaC15H19NO3S2
Molecular Weight325.46 g/mol
Exact Mass325.08
IUPAC Name5-ethyl-N-(2-hydroxy-2-phenylpropyl)thiophene-2-sulfonamide
SMILESCCc1ccc(S(=O)(=O)NCC(C)(O)c2ccccc2)s1
InChIInChI=1S/C15H19NO3S2/c1-3-13-9-10-14(20-13)21(18,19)16-11-15(2,17)12-7-5-4-6-8-12/h4-10,16-17H,3,11H2,1-2H3
InChIKeyGZOOZWDXHNVNRS-UHFFFAOYSA-N
XLogP2.50
TPSA66.40 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.46
LogP ≤ 52.50
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2-amino-2-methylpropyl)-5-ethylthiophene-2-sulfonamide
CID 115303410
5-bromo-N-(2-hydroxy-2-phenylpropyl)thiophene-2-sulfonamide
CID 56765391
N-(1-bromo-2-phenylpropan-2-yl)-5-ethylthiophene-2-sulfonamide
CID 105060223
5-ethyl-N-(2-hydroxy-3-phenylpropyl)thiophene-2-sulfonamide
CID 90534466
N-[(2S)-2-hydroxy-2-phenylpropyl]methanesulfonamide
CID 95368033
5-ethyl-N-(2-oxopropyl)thiophene-2-sulfonamide
CID 64994375
5-ethyl-N-(2-methylprop-2-enyl)thiophene-2-sulfonamide
CID 114616513
3-[[(5-ethylthiophen-2-yl)sulfonylamino]methyl]benzoic acid
CID 61454207
N-(cyanomethyl)-5-ethylthiophene-2-sulfonamide
CID 61454174
4-bromo-N-[(2R)-2-hydroxy-2-phenylpropyl]benzenesulfonamide
CID 95368070
5-ethyl-N-(2-ethylbutyl)thiophene-2-sulfonamide
CID 115613311
N-[[5-[(2-amino-2-methylpropyl)sulfamoyl]thiophen-2-yl]methyl]acetamide;hydrochloride
CID 119988458

Frequently Asked Questions

What is the IUPAC name of 5-ethyl-N-(2-hydroxy-2-phenylpropyl)thiophene-2-sulfonamide?
The IUPAC name of 5-ethyl-N-(2-hydroxy-2-phenylpropyl)thiophene-2-sulfonamide (CID 110664046) is 5-ethyl-N-(2-hydroxy-2-phenylpropyl)thiophene-2-sulfonamide.
What is the SMILES notation for 5-ethyl-N-(2-hydroxy-2-phenylpropyl)thiophene-2-sulfonamide?
The canonical SMILES for 5-ethyl-N-(2-hydroxy-2-phenylpropyl)thiophene-2-sulfonamide is CCc1ccc(S(=O)(=O)NCC(C)(O)c2ccccc2)s1.
What is the InChIKey of 5-ethyl-N-(2-hydroxy-2-phenylpropyl)thiophene-2-sulfonamide?
The InChIKey is GZOOZWDXHNVNRS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19NO3S2/c1-3-13-9-10-14(20-13)21(18,19)16-11-15(2,17)12-7-5-4-6-8-12/h4-10,16-17H,3,11H2,1-2H3.
What are the key properties of 5-ethyl-N-(2-hydroxy-2-phenylpropyl)thiophene-2-sulfonamide?
5-ethyl-N-(2-hydroxy-2-phenylpropyl)thiophene-2-sulfonamide has a molecular weight of 325.46 g/mol, XLogP of 2.50, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethyl-N-(2-hydroxy-2-phenylpropyl)thiophene-2-sulfonamide is sourced from PubChem (CID 110664046), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).