N-[3-(3-hydroxypropyl)phenyl]thiophene-3-carboxamide

C14H15NO2S — CID 113372023

IUPACN-[3-(3-hydroxypropyl)phenyl]thiophene-3-carboxamide
SMILESO=C(Nc1cccc(CCCO)c1)c1ccsc1
InChIInChI=1S/C14H15NO2S/c16-7-2-4-11-3-1-5-13(9-11)15-14(17)12-6-8-18-10-12/h1,3,5-6,8-10,16H,2,4,7H2,(H,15,17)
InChIKeyRPXDFROEDMZPEF-UHFFFAOYSA-N
MW261.35 g/mol
LogP2.93
Rot. Bonds5

About N-[3-(3-hydroxypropyl)phenyl]thiophene-3-carboxamide

N-[3-(3-hydroxypropyl)phenyl]thiophene-3-carboxamide (PubChem CID 113372023) has the molecular formula C14H15NO2S and a molecular weight of 261.35 g/mol. Its IUPAC name is N-[3-(3-hydroxypropyl)phenyl]thiophene-3-carboxamide.

Molecular Properties

Compound NameN-[3-(3-hydroxypropyl)phenyl]thiophene-3-carboxamide
PubChem CID113372023
Molecular FormulaC14H15NO2S
Molecular Weight261.35 g/mol
Exact Mass261.08
IUPAC NameN-[3-(3-hydroxypropyl)phenyl]thiophene-3-carboxamide
SMILESO=C(Nc1cccc(CCCO)c1)c1ccsc1
InChIInChI=1S/C14H15NO2S/c16-7-2-4-11-3-1-5-13(9-11)15-14(17)12-6-8-18-10-12/h1,3,5-6,8-10,16H,2,4,7H2,(H,15,17)
InChIKeyRPXDFROEDMZPEF-UHFFFAOYSA-N
XLogP2.93
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.35
LogP ≤ 52.93
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze N-[3-(3-hydroxypropyl)phenyl]thiophene-3-carboxamide 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-[3-(aminomethyl)phenyl]thiophene-3-carboxamide
CID 63254340
2,6-dihydroxy-N-[3-(3-hydroxypropyl)phenyl]benzamide
CID 107689573
N-(3-carbamoylphenyl)thiophene-3-carboxamide
CID 17015852
2,3-dihydroxy-N-[3-(3-hydroxypropyl)phenyl]benzamide
CID 114344635
N-[3-(2-hydroxyethyl)phenyl]benzamide
CID 139896443
N-[3-(sulfamoylamino)phenyl]thiophene-3-carboxamide
CID 60728385
N-(3-sulfamoylphenyl)thiophene-3-carboxamide
CID 60656415
1-[[3-(thiophene-3-carbonylamino)phenyl]methyl]piperidine-4-carboxamide
CID 71941024
N-[3-(3-hydroxypropyl)phenyl]azetidine-3-carboxamide
CID 113397733
N-[3-(2,2,2-trifluoroethylcarbamoyl)phenyl]thiophene-3-carboxamide
CID 17444241
5-chloro-N-[3-(3-hydroxypropyl)phenyl]pyrazine-2-carboxamide
CID 107372169
2-bromo-N-[3-(3-hydroxypropyl)phenyl]propanamide
CID 107905690

Frequently Asked Questions

What is the IUPAC name of N-[3-(3-hydroxypropyl)phenyl]thiophene-3-carboxamide?
The IUPAC name of N-[3-(3-hydroxypropyl)phenyl]thiophene-3-carboxamide (CID 113372023) is N-[3-(3-hydroxypropyl)phenyl]thiophene-3-carboxamide.
What is the SMILES notation for N-[3-(3-hydroxypropyl)phenyl]thiophene-3-carboxamide?
The canonical SMILES for N-[3-(3-hydroxypropyl)phenyl]thiophene-3-carboxamide is O=C(Nc1cccc(CCCO)c1)c1ccsc1.
What is the InChIKey of N-[3-(3-hydroxypropyl)phenyl]thiophene-3-carboxamide?
The InChIKey is RPXDFROEDMZPEF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15NO2S/c16-7-2-4-11-3-1-5-13(9-11)15-14(17)12-6-8-18-10-12/h1,3,5-6,8-10,16H,2,4,7H2,(H,15,17).
What are the key properties of N-[3-(3-hydroxypropyl)phenyl]thiophene-3-carboxamide?
N-[3-(3-hydroxypropyl)phenyl]thiophene-3-carboxamide has a molecular weight of 261.35 g/mol, XLogP of 2.93, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(3-hydroxypropyl)phenyl]thiophene-3-carboxamide is sourced from PubChem (CID 113372023), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).