N-(2-hydroxy-2-thiophen-3-ylpropyl)benzamide

C14H15NO2S — CID 111451803

IUPACN-(2-hydroxy-2-thiophen-3-ylpropyl)benzamide
SMILESCC(O)(CNC(=O)c1ccccc1)c1ccsc1
InChIInChI=1S/C14H15NO2S/c1-14(17,12-7-8-18-9-12)10-15-13(16)11-5-3-2-4-6-11/h2-9,17H,10H2,1H3,(H,15,16)
InChIKeyZNCHFLNHVCGUNM-UHFFFAOYSA-N
MW261.35 g/mol
LogP2.39
Rot. Bonds4

About N-(2-hydroxy-2-thiophen-3-ylpropyl)benzamide

N-(2-hydroxy-2-thiophen-3-ylpropyl)benzamide (PubChem CID 111451803) has the molecular formula C14H15NO2S and a molecular weight of 261.35 g/mol. Its IUPAC name is N-(2-hydroxy-2-thiophen-3-ylpropyl)benzamide.

Molecular Properties

Compound NameN-(2-hydroxy-2-thiophen-3-ylpropyl)benzamide
PubChem CID111451803
Molecular FormulaC14H15NO2S
Molecular Weight261.35 g/mol
Exact Mass261.08
IUPAC NameN-(2-hydroxy-2-thiophen-3-ylpropyl)benzamide
SMILESCC(O)(CNC(=O)c1ccccc1)c1ccsc1
InChIInChI=1S/C14H15NO2S/c1-14(17,12-7-8-18-9-12)10-15-13(16)11-5-3-2-4-6-11/h2-9,17H,10H2,1H3,(H,15,16)
InChIKeyZNCHFLNHVCGUNM-UHFFFAOYSA-N
XLogP2.39
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.35
LogP ≤ 52.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze N-(2-hydroxy-2-thiophen-3-ylpropyl)benzamide 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

3-bromo-N-(2-hydroxy-2-thiophen-3-ylpropyl)benzamide
CID 111452155
N-(2-hydroxy-2-thiophen-3-ylpropyl)-4-(methoxymethyl)benzamide
CID 111452317
N-(2-hydroxy-2-thiophen-3-ylpropyl)-3-(methoxymethyl)benzamide
CID 111452131
1-(2-hydroxy-2-thiophen-3-ylpropyl)-3-phenylurea
CID 111450187
3,4-dichloro-N-(2-hydroxy-2-thiophen-3-ylpropyl)benzamide
CID 111452323
3,4-difluoro-N-[(2S)-2-hydroxy-2-thiophen-3-ylpropyl]benzamide
CID 96521380
N-[2-[(2-hydroxy-2-thiophen-3-ylpropyl)amino]-2-oxoethyl]-2-phenylacetamide
CID 111452114
4-(difluoromethylsulfanyl)-N-(2-hydroxy-2-thiophen-3-ylpropyl)benzamide
CID 111452036
N-(2-hydroxy-2-thiophen-3-ylpropyl)-2,2-dimethylpropanamide
CID 111452293
N-(2-hydroxy-2-thiophen-3-ylpropyl)furan-2-carboxamide
CID 111452151
N-(2-hydroxy-2-thiophen-3-ylpropyl)-1-methyl-6-oxopyridine-3-carboxamide
CID 111452101
N-[(2S)-2-hydroxy-2-thiophen-3-ylpropyl]-5-phenyl-1,2-oxazole-3-carboxamide
CID 96521382

Frequently Asked Questions

What is the IUPAC name of N-(2-hydroxy-2-thiophen-3-ylpropyl)benzamide?
The IUPAC name of N-(2-hydroxy-2-thiophen-3-ylpropyl)benzamide (CID 111451803) is N-(2-hydroxy-2-thiophen-3-ylpropyl)benzamide.
What is the SMILES notation for N-(2-hydroxy-2-thiophen-3-ylpropyl)benzamide?
The canonical SMILES for N-(2-hydroxy-2-thiophen-3-ylpropyl)benzamide is CC(O)(CNC(=O)c1ccccc1)c1ccsc1.
What is the InChIKey of N-(2-hydroxy-2-thiophen-3-ylpropyl)benzamide?
The InChIKey is ZNCHFLNHVCGUNM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15NO2S/c1-14(17,12-7-8-18-9-12)10-15-13(16)11-5-3-2-4-6-11/h2-9,17H,10H2,1H3,(H,15,16).
What are the key properties of N-(2-hydroxy-2-thiophen-3-ylpropyl)benzamide?
N-(2-hydroxy-2-thiophen-3-ylpropyl)benzamide has a molecular weight of 261.35 g/mol, XLogP of 2.39, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-hydroxy-2-thiophen-3-ylpropyl)benzamide is sourced from PubChem (CID 111451803), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).