N-(2-hydroxy-1-phenylethyl)-5-methylthiophene-2-carboxamide

C14H15NO2S — CID 63184449

IUPACN-(2-hydroxy-1-phenylethyl)-5-methylthiophene-2-carboxamide
SMILESCc1ccc(C(=O)NC(CO)c2ccccc2)s1
InChIInChI=1S/C14H15NO2S/c1-10-7-8-13(18-10)14(17)15-12(9-16)11-5-3-2-4-6-11/h2-8,12,16H,9H2,1H3,(H,15,17)
InChIKeyRBLKQKDZCVBSDL-UHFFFAOYSA-N
MW261.35 g/mol
LogP2.52
Rot. Bonds4

About N-(2-hydroxy-1-phenylethyl)-5-methylthiophene-2-carboxamide

N-(2-hydroxy-1-phenylethyl)-5-methylthiophene-2-carboxamide (PubChem CID 63184449) has the molecular formula C14H15NO2S and a molecular weight of 261.35 g/mol. Its IUPAC name is N-(2-hydroxy-1-phenylethyl)-5-methylthiophene-2-carboxamide.

Molecular Properties

Compound NameN-(2-hydroxy-1-phenylethyl)-5-methylthiophene-2-carboxamide
PubChem CID63184449
Molecular FormulaC14H15NO2S
Molecular Weight261.35 g/mol
Exact Mass261.08
IUPAC NameN-(2-hydroxy-1-phenylethyl)-5-methylthiophene-2-carboxamide
SMILESCc1ccc(C(=O)NC(CO)c2ccccc2)s1
InChIInChI=1S/C14H15NO2S/c1-10-7-8-13(18-10)14(17)15-12(9-16)11-5-3-2-4-6-11/h2-8,12,16H,9H2,1H3,(H,15,17)
InChIKeyRBLKQKDZCVBSDL-UHFFFAOYSA-N
XLogP2.52
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 ≤ 52.52
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze N-(2-hydroxy-1-phenylethyl)-5-methylthiophene-2-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

5-chloro-N-(2-hydroxy-1-phenylethyl)thiophene-2-carboxamide
CID 63182495
N-(2-hydroxy-1-phenylethyl)-5-nitrothiophene-2-carboxamide
CID 63182470
[4-[(1S)-1-[(5-benzhydrylthiophene-2-carbonyl)amino]-2-hydroxyethyl]phenyl]carbamic acid
CID 69269566
N-(2-hydroxy-1-phenylethyl)-5-methyl-4-propylthiophene-2-carboxamide
CID 63182272
N-(2-hydroxy-1-phenylethyl)benzamide
CID 14150746
2-N-hydroxy-5-N-(3-hydroxy-1-phenylpropyl)thiophene-2,5-dicarboxamide
CID 10064609
5-acetyl-N-[(1R)-2-(dimethylamino)-1-phenylethyl]thiophene-2-carboxamide
CID 8938472
1-[(1S)-2-hydroxy-1-phenylethyl]-3-[(5-methylthiophen-2-yl)methyl]urea
CID 75448635
1-N,3-N,5-N-tris(2-hydroxy-1-phenylethyl)benzene-1,3,5-tricarboxamide
CID 139248401
N-(2-hydroxy-1-phenylethyl)benzamide;hydrochloride
CID 175746997
(E)-N-[(1R)-2-hydroxy-1-phenylethyl]-3-(5-methylthiophen-2-yl)prop-2-enamide
CID 103944452
5-(2-aminopyrimidin-4-yl)-N-[(1R)-2-hydroxy-1-phenylethyl]thiophene-2-carboxamide
CID 59849648

Frequently Asked Questions

What is the IUPAC name of N-(2-hydroxy-1-phenylethyl)-5-methylthiophene-2-carboxamide?
The IUPAC name of N-(2-hydroxy-1-phenylethyl)-5-methylthiophene-2-carboxamide (CID 63184449) is N-(2-hydroxy-1-phenylethyl)-5-methylthiophene-2-carboxamide.
What is the SMILES notation for N-(2-hydroxy-1-phenylethyl)-5-methylthiophene-2-carboxamide?
The canonical SMILES for N-(2-hydroxy-1-phenylethyl)-5-methylthiophene-2-carboxamide is Cc1ccc(C(=O)NC(CO)c2ccccc2)s1.
What is the InChIKey of N-(2-hydroxy-1-phenylethyl)-5-methylthiophene-2-carboxamide?
The InChIKey is RBLKQKDZCVBSDL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15NO2S/c1-10-7-8-13(18-10)14(17)15-12(9-16)11-5-3-2-4-6-11/h2-8,12,16H,9H2,1H3,(H,15,17).
What are the key properties of N-(2-hydroxy-1-phenylethyl)-5-methylthiophene-2-carboxamide?
N-(2-hydroxy-1-phenylethyl)-5-methylthiophene-2-carboxamide has a molecular weight of 261.35 g/mol, XLogP of 2.52, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-hydroxy-1-phenylethyl)-5-methylthiophene-2-carboxamide is sourced from PubChem (CID 63184449), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).