N-(3-hydroxy-2-phenylpropyl)thiophene-2-sulfonamide

C13H15NO3S2 — CID 86589102

IUPACN-(3-hydroxy-2-phenylpropyl)thiophene-2-sulfonamide
SMILESO=S(=O)(NCC(CO)c1ccccc1)c1cccs1
InChIInChI=1S/C13H15NO3S2/c15-10-12(11-5-2-1-3-6-11)9-14-19(16,17)13-7-4-8-18-13/h1-8,12,14-15H,9-10H2
InChIKeyFGSWQVSKTXDHLV-UHFFFAOYSA-N
MW297.40 g/mol
LogP1.80
Rot. Bonds6

About N-(3-hydroxy-2-phenylpropyl)thiophene-2-sulfonamide

N-(3-hydroxy-2-phenylpropyl)thiophene-2-sulfonamide (PubChem CID 86589102) has the molecular formula C13H15NO3S2 and a molecular weight of 297.40 g/mol. Its IUPAC name is N-(3-hydroxy-2-phenylpropyl)thiophene-2-sulfonamide.

Molecular Properties

Compound NameN-(3-hydroxy-2-phenylpropyl)thiophene-2-sulfonamide
PubChem CID86589102
Molecular FormulaC13H15NO3S2
Molecular Weight297.40 g/mol
Exact Mass297.05
IUPAC NameN-(3-hydroxy-2-phenylpropyl)thiophene-2-sulfonamide
SMILESO=S(=O)(NCC(CO)c1ccccc1)c1cccs1
InChIInChI=1S/C13H15NO3S2/c15-10-12(11-5-2-1-3-6-11)9-14-19(16,17)13-7-4-8-18-13/h1-8,12,14-15H,9-10H2
InChIKeyFGSWQVSKTXDHLV-UHFFFAOYSA-N
XLogP1.80
TPSA66.40 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.40
LogP ≤ 51.80
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze N-(3-hydroxy-2-phenylpropyl)thiophene-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

N-(2,2-diphenylethyl)thiophene-2-sulfonamide
CID 4994922
2-phenyl-3-(thiophen-2-ylsulfonylamino)propanoic acid
CID 62882270
2-hydroxy-3-(thiophen-2-ylsulfonylamino)propanoic acid
CID 66168152
N-(3-hydroxy-3-phenylpropyl)thiophene-2-sulfonamide
CID 90499598
N-[(S)-phenyl(thiophen-2-yl)methyl]thiophene-2-sulfonamide
CID 8815899
N-[(R)-phenyl(thiophen-2-yl)methyl]thiophene-2-sulfonamide
CID 8815903
N-(2-phenylbutyl)-3-(thiophen-2-ylsulfonylamino)benzamide
CID 46489998
N-[3-(1-phenylethoxy)propyl]thiophene-2-sulfonamide
CID 51307272
N-(2-bromo-2-cyclopropylethyl)thiophene-2-sulfonamide
CID 114294509
N-(1,3-dihydroxypropan-2-yl)-3-(thiophen-2-ylsulfonylamino)propanamide
CID 65315408
2-chloro-N-[(2R)-2-phenyl-2-thiophen-2-ylsulfonylethyl]benzenesulfonamide
CID 51662811
N-(2-methoxy-2-thiophen-3-ylethyl)thiophene-2-sulfonamide
CID 90584008

Frequently Asked Questions

What is the IUPAC name of N-(3-hydroxy-2-phenylpropyl)thiophene-2-sulfonamide?
The IUPAC name of N-(3-hydroxy-2-phenylpropyl)thiophene-2-sulfonamide (CID 86589102) is N-(3-hydroxy-2-phenylpropyl)thiophene-2-sulfonamide.
What is the SMILES notation for N-(3-hydroxy-2-phenylpropyl)thiophene-2-sulfonamide?
The canonical SMILES for N-(3-hydroxy-2-phenylpropyl)thiophene-2-sulfonamide is O=S(=O)(NCC(CO)c1ccccc1)c1cccs1.
What is the InChIKey of N-(3-hydroxy-2-phenylpropyl)thiophene-2-sulfonamide?
The InChIKey is FGSWQVSKTXDHLV-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15NO3S2/c15-10-12(11-5-2-1-3-6-11)9-14-19(16,17)13-7-4-8-18-13/h1-8,12,14-15H,9-10H2.
What are the key properties of N-(3-hydroxy-2-phenylpropyl)thiophene-2-sulfonamide?
N-(3-hydroxy-2-phenylpropyl)thiophene-2-sulfonamide has a molecular weight of 297.40 g/mol, XLogP of 1.80, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-hydroxy-2-phenylpropyl)thiophene-2-sulfonamide is sourced from PubChem (CID 86589102), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).