2-[4-(2-thiophen-2-ylethylamino)phenyl]ethanol

C14H17NOS — CID 51361048

IUPAC2-[4-(2-thiophen-2-ylethylamino)phenyl]ethanol
SMILESOCCc1ccc(NCCc2cccs2)cc1
InChIInChI=1S/C14H17NOS/c16-10-8-12-3-5-13(6-4-12)15-9-7-14-2-1-11-17-14/h1-6,11,15-16H,7-10H2
InChIKeyGJLATUQBMMDGAW-UHFFFAOYSA-N
MW247.36 g/mol
LogP2.94
Rot. Bonds6

About 2-[4-(2-thiophen-2-ylethylamino)phenyl]ethanol

2-[4-(2-thiophen-2-ylethylamino)phenyl]ethanol (PubChem CID 51361048) has the molecular formula C14H17NOS and a molecular weight of 247.36 g/mol. Its IUPAC name is 2-[4-(2-thiophen-2-ylethylamino)phenyl]ethanol.

Molecular Properties

Compound Name2-[4-(2-thiophen-2-ylethylamino)phenyl]ethanol
PubChem CID51361048
Molecular FormulaC14H17NOS
Molecular Weight247.36 g/mol
Exact Mass247.10
IUPAC Name2-[4-(2-thiophen-2-ylethylamino)phenyl]ethanol
SMILESOCCc1ccc(NCCc2cccs2)cc1
InChIInChI=1S/C14H17NOS/c16-10-8-12-3-5-13(6-4-12)15-9-7-14-2-1-11-17-14/h1-6,11,15-16H,7-10H2
InChIKeyGJLATUQBMMDGAW-UHFFFAOYSA-N
XLogP2.94
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.36
LogP ≤ 52.94
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-[4-(2-thiophen-2-ylethylamino)phenyl]ethanol?
The IUPAC name of 2-[4-(2-thiophen-2-ylethylamino)phenyl]ethanol (CID 51361048) is 2-[4-(2-thiophen-2-ylethylamino)phenyl]ethanol.
What is the SMILES notation for 2-[4-(2-thiophen-2-ylethylamino)phenyl]ethanol?
The canonical SMILES for 2-[4-(2-thiophen-2-ylethylamino)phenyl]ethanol is OCCc1ccc(NCCc2cccs2)cc1.
What is the InChIKey of 2-[4-(2-thiophen-2-ylethylamino)phenyl]ethanol?
The InChIKey is GJLATUQBMMDGAW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17NOS/c16-10-8-12-3-5-13(6-4-12)15-9-7-14-2-1-11-17-14/h1-6,11,15-16H,7-10H2.
What are the key properties of 2-[4-(2-thiophen-2-ylethylamino)phenyl]ethanol?
2-[4-(2-thiophen-2-ylethylamino)phenyl]ethanol has a molecular weight of 247.36 g/mol, XLogP of 2.94, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(2-thiophen-2-ylethylamino)phenyl]ethanol is sourced from PubChem (CID 51361048), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).