2-amino-2-[3-(trifluoromethyl)thiophen-2-yl]ethanol

C7H8F3NOS — CID 130000670

IUPAC2-amino-2-[3-(trifluoromethyl)thiophen-2-yl]ethanol
SMILESNC(CO)c1sccc1C(F)(F)F
InChIInChI=1S/C7H8F3NOS/c8-7(9,10)4-1-2-13-6(4)5(11)3-12/h1-2,5,12H,3,11H2
InChIKeyFVCJEYJPSSMUGD-UHFFFAOYSA-N
MW211.21 g/mol
LogP1.76
Rot. Bonds2

About 2-amino-2-[3-(trifluoromethyl)thiophen-2-yl]ethanol

2-amino-2-[3-(trifluoromethyl)thiophen-2-yl]ethanol (PubChem CID 130000670) has the molecular formula C7H8F3NOS and a molecular weight of 211.21 g/mol. Its IUPAC name is 2-amino-2-[3-(trifluoromethyl)thiophen-2-yl]ethanol.

Molecular Properties

Compound Name2-amino-2-[3-(trifluoromethyl)thiophen-2-yl]ethanol
PubChem CID130000670
Molecular FormulaC7H8F3NOS
Molecular Weight211.21 g/mol
Exact Mass211.03
IUPAC Name2-amino-2-[3-(trifluoromethyl)thiophen-2-yl]ethanol
SMILESNC(CO)c1sccc1C(F)(F)F
InChIInChI=1S/C7H8F3NOS/c8-7(9,10)4-1-2-13-6(4)5(11)3-12/h1-2,5,12H,3,11H2
InChIKeyFVCJEYJPSSMUGD-UHFFFAOYSA-N
XLogP1.76
TPSA46.25 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.21
LogP ≤ 51.76
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-Amino-2-(3-methylthiophen-2-yl)ethan-1-ol hydrochloride
CID 71755403
2-Amino-2-(thiophen-3-yl)ethan-1-ol hydrochloride
CID 170891880
[2-Hydroxy-1-(thiophen-2-YL)ethyl]amine
CID 54000759
(2R)-2-amino-2-{5-[(1S)-1-amino-2,2,2-trifluoroethyl]thiophen-2-yl}ethanol dihydrochloride salt
CID 117628552
(2R)-2-amino-2-[5-[(1S)-1-amino-2,2,2-trifluoroethyl]thiophen-2-yl]ethanol
CID 117628553
(2S)-1-amino-1-(2-fluorothiophen-3-yl)propan-2-ol
CID 142633970
(2S)-2-amino-2-[5-(difluoromethyl)thiophen-3-yl]ethanol
CID 55275402
2-Amino-2-[5-(difluoromethyl)thiophen-3-yl]ethanol
CID 55296160
2-Thiophen-2-yl-2-(2,2,2-trifluoroethylamino)ethanol
CID 61346381
2-(3-Methylthiophen-2-yl)-2-(2,2,2-trifluoroethylamino)ethanol
CID 61346398
2-(2,5-Dimethylthiophen-3-yl)-2-(2,2,2-trifluoroethylamino)ethanol
CID 61556944
4-Amino-1,1,1-trifluoro-3-thiophen-2-ylbutan-2-ol
CID 65190404

Frequently Asked Questions

What is the IUPAC name of 2-amino-2-[3-(trifluoromethyl)thiophen-2-yl]ethanol?
The IUPAC name of 2-amino-2-[3-(trifluoromethyl)thiophen-2-yl]ethanol (CID 130000670) is 2-amino-2-[3-(trifluoromethyl)thiophen-2-yl]ethanol.
What is the SMILES notation for 2-amino-2-[3-(trifluoromethyl)thiophen-2-yl]ethanol?
The canonical SMILES for 2-amino-2-[3-(trifluoromethyl)thiophen-2-yl]ethanol is NC(CO)c1sccc1C(F)(F)F.
What is the InChIKey of 2-amino-2-[3-(trifluoromethyl)thiophen-2-yl]ethanol?
The InChIKey is FVCJEYJPSSMUGD-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H8F3NOS/c8-7(9,10)4-1-2-13-6(4)5(11)3-12/h1-2,5,12H,3,11H2.
What are the key properties of 2-amino-2-[3-(trifluoromethyl)thiophen-2-yl]ethanol?
2-amino-2-[3-(trifluoromethyl)thiophen-2-yl]ethanol has a molecular weight of 211.21 g/mol, XLogP of 1.76, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-2-[3-(trifluoromethyl)thiophen-2-yl]ethanol is sourced from PubChem (CID 130000670), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).