2-amino-1-[5-(2-methylphenyl)thiophen-2-yl]ethanol

C13H15NOS — CID 82116281

IUPAC2-amino-1-[5-(2-methylphenyl)thiophen-2-yl]ethanol
SMILESCc1ccccc1-c1ccc(C(O)CN)s1
InChIInChI=1S/C13H15NOS/c1-9-4-2-3-5-10(9)12-6-7-13(16-12)11(15)8-14/h2-7,11,15H,8,14H2,1H3
InChIKeyLYHHQWUVOYTUHQ-UHFFFAOYSA-N
MW233.34 g/mol
LogP2.72
Rot. Bonds3

About 2-amino-1-[5-(2-methylphenyl)thiophen-2-yl]ethanol

2-amino-1-[5-(2-methylphenyl)thiophen-2-yl]ethanol (PubChem CID 82116281) has the molecular formula C13H15NOS and a molecular weight of 233.34 g/mol. Its IUPAC name is 2-amino-1-[5-(2-methylphenyl)thiophen-2-yl]ethanol.

Molecular Properties

Compound Name2-amino-1-[5-(2-methylphenyl)thiophen-2-yl]ethanol
PubChem CID82116281
Molecular FormulaC13H15NOS
Molecular Weight233.34 g/mol
Exact Mass233.09
IUPAC Name2-amino-1-[5-(2-methylphenyl)thiophen-2-yl]ethanol
SMILESCc1ccccc1-c1ccc(C(O)CN)s1
InChIInChI=1S/C13H15NOS/c1-9-4-2-3-5-10(9)12-6-7-13(16-12)11(15)8-14/h2-7,11,15H,8,14H2,1H3
InChIKeyLYHHQWUVOYTUHQ-UHFFFAOYSA-N
XLogP2.72
TPSA46.25 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.34
LogP ≤ 52.72
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 2-amino-1-[5-(2-methylphenyl)thiophen-2-yl]ethanol 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

2-methyl-1-[5-(2-methylphenyl)thiophen-2-yl]propan-1-amine
CID 43363500
2-amino-1-[5-(3-chlorophenyl)thiophen-2-yl]ethanol
CID 82120008
N-[cyclopropyl-[5-(2-methylphenyl)thiophen-2-yl]methyl]ethanamine
CID 43288356
2-amino-1-(5-methoxythiophen-2-yl)ethanol
CID 130587547
3-[5-(2-chlorophenyl)thiophen-2-yl]butan-1-amine
CID 82542688
1-(5-chlorothiophen-2-yl)-3-(2-methylphenyl)propan-1-ol
CID 105119687
1-[5-(2,3-dimethylphenyl)thiophen-2-yl]-N-propylpropan-1-amine
CID 43287611
4,7-bis[5-(2-methylphenyl)thiophen-2-yl]-2,1,3-benzothiadiazole
CID 58610797
1-[5-(2,5-dimethylphenyl)thiophen-2-yl]-N-ethylethanamine
CID 43287935
3-amino-5-(2-methylphenyl)thiophene-2-carboxylic acid
CID 83035559
5-(2-methylphenyl)thiophene-2-sulfonyl chloride
CID 22998464
N-[1-[5-(2-propan-2-ylphenyl)thiophen-2-yl]ethyl]propan-1-amine
CID 43287695

Frequently Asked Questions

What is the IUPAC name of 2-amino-1-[5-(2-methylphenyl)thiophen-2-yl]ethanol?
The IUPAC name of 2-amino-1-[5-(2-methylphenyl)thiophen-2-yl]ethanol (CID 82116281) is 2-amino-1-[5-(2-methylphenyl)thiophen-2-yl]ethanol.
What is the SMILES notation for 2-amino-1-[5-(2-methylphenyl)thiophen-2-yl]ethanol?
The canonical SMILES for 2-amino-1-[5-(2-methylphenyl)thiophen-2-yl]ethanol is Cc1ccccc1-c1ccc(C(O)CN)s1.
What is the InChIKey of 2-amino-1-[5-(2-methylphenyl)thiophen-2-yl]ethanol?
The InChIKey is LYHHQWUVOYTUHQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15NOS/c1-9-4-2-3-5-10(9)12-6-7-13(16-12)11(15)8-14/h2-7,11,15H,8,14H2,1H3.
What are the key properties of 2-amino-1-[5-(2-methylphenyl)thiophen-2-yl]ethanol?
2-amino-1-[5-(2-methylphenyl)thiophen-2-yl]ethanol has a molecular weight of 233.34 g/mol, XLogP of 2.72, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-1-[5-(2-methylphenyl)thiophen-2-yl]ethanol is sourced from PubChem (CID 82116281), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).