(2R)-2-phenyl-2-(1-thiophen-2-ylethylamino)ethanol

C14H17NOS — CID 103788696

IUPAC(2R)-2-phenyl-2-(1-thiophen-2-ylethylamino)ethanol
SMILESCC(N[C@@H](CO)c1ccccc1)c1cccs1
InChIInChI=1S/C14H17NOS/c1-11(14-8-5-9-17-14)15-13(10-16)12-6-3-2-4-7-12/h2-9,11,13,15-16H,10H2,1H3/t11?,13-/m0/s1
InChIKeyXJNUYHHZXJCEOK-YUZLPWPTSA-N
MW247.36 g/mol
LogP3.13
Rot. Bonds5

About (2R)-2-phenyl-2-(1-thiophen-2-ylethylamino)ethanol

(2R)-2-phenyl-2-(1-thiophen-2-ylethylamino)ethanol (PubChem CID 103788696) has the molecular formula C14H17NOS and a molecular weight of 247.36 g/mol. Its IUPAC name is (2R)-2-phenyl-2-(1-thiophen-2-ylethylamino)ethanol.

Molecular Properties

Compound Name(2R)-2-phenyl-2-(1-thiophen-2-ylethylamino)ethanol
PubChem CID103788696
Molecular FormulaC14H17NOS
Molecular Weight247.36 g/mol
Exact Mass247.10
IUPAC Name(2R)-2-phenyl-2-(1-thiophen-2-ylethylamino)ethanol
SMILESCC(N[C@@H](CO)c1ccccc1)c1cccs1
InChIInChI=1S/C14H17NOS/c1-11(14-8-5-9-17-14)15-13(10-16)12-6-3-2-4-7-12/h2-9,11,13,15-16H,10H2,1H3/t11?,13-/m0/s1
InChIKeyXJNUYHHZXJCEOK-YUZLPWPTSA-N
XLogP3.13
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.36
LogP ≤ 53.13
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-phenyl-N-[(1S)-1-thiophen-2-ylethyl]propan-1-amine
CID 81398812
1-phenyl-N-[(1S)-1-thiophen-2-ylethyl]butan-1-amine
CID 81399284
2-phenyl-2-(1-thiophen-2-ylpropylamino)ethanol
CID 63182371
2-[1-(4-bromothiophen-2-yl)ethylamino]-2-phenylethanol
CID 107167453
(2R)-2-[[(1R)-2-hydroxy-1-phenylethyl]amino]-2-thiophen-2-ylacetic acid
CID 11044071
2-methyl-1-phenyl-N-[(1R)-1-thiophen-2-ylethyl]propan-1-amine
CID 81398198
1-(4-methylphenyl)-N-[(1S)-1-thiophen-2-ylethyl]propan-1-amine
CID 81398298
1-(4-methylphenyl)-N-(1-thiophen-2-ylethyl)propan-1-amine
CID 43206039
(2S)-2-[[cyclopentyl(thiophen-2-yl)methyl]amino]-2-phenylethanol
CID 107862229
2-(1-thiophen-2-ylethylamino)butan-1-ol
CID 43207104
1-(4-ethylphenyl)-N-[(1R)-1-thiophen-2-ylethyl]propan-1-amine
CID 81399236
2-[1-(4-bromophenyl)ethylamino]-2-phenylethanol
CID 55158261

Frequently Asked Questions

What is the IUPAC name of (2R)-2-phenyl-2-(1-thiophen-2-ylethylamino)ethanol?
The IUPAC name of (2R)-2-phenyl-2-(1-thiophen-2-ylethylamino)ethanol (CID 103788696) is (2R)-2-phenyl-2-(1-thiophen-2-ylethylamino)ethanol.
What is the SMILES notation for (2R)-2-phenyl-2-(1-thiophen-2-ylethylamino)ethanol?
The canonical SMILES for (2R)-2-phenyl-2-(1-thiophen-2-ylethylamino)ethanol is CC(N[C@@H](CO)c1ccccc1)c1cccs1.
What is the InChIKey of (2R)-2-phenyl-2-(1-thiophen-2-ylethylamino)ethanol?
The InChIKey is XJNUYHHZXJCEOK-YUZLPWPTSA-N. The full InChI is InChI=1S/C14H17NOS/c1-11(14-8-5-9-17-14)15-13(10-16)12-6-3-2-4-7-12/h2-9,11,13,15-16H,10H2,1H3/t11?,13-/m0/s1.
What are the key properties of (2R)-2-phenyl-2-(1-thiophen-2-ylethylamino)ethanol?
(2R)-2-phenyl-2-(1-thiophen-2-ylethylamino)ethanol has a molecular weight of 247.36 g/mol, XLogP of 3.13, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-phenyl-2-(1-thiophen-2-ylethylamino)ethanol is sourced from PubChem (CID 103788696), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).