(2R)-2-amino-2-[5-(difluoromethyl)thiophen-3-yl]ethanol

C7H9F2NOS — CID 130692072

IUPAC(2R)-2-amino-2-[5-(difluoromethyl)thiophen-3-yl]ethanol
SMILESN[C@@H](CO)c1csc(C(F)F)c1
InChIInChI=1S/C7H9F2NOS/c8-7(9)6-1-4(3-12-6)5(10)2-11/h1,3,5,7,11H,2,10H2/t5-/m0/s1
InChIKeyRUGCAAGDRGULAB-YFKPBYRVSA-N
MW193.22 g/mol
LogP1.68
Rot. Bonds3

About (2R)-2-amino-2-[5-(difluoromethyl)thiophen-3-yl]ethanol

(2R)-2-amino-2-[5-(difluoromethyl)thiophen-3-yl]ethanol (PubChem CID 130692072) has the molecular formula C7H9F2NOS and a molecular weight of 193.22 g/mol. Its IUPAC name is (2R)-2-amino-2-[5-(difluoromethyl)thiophen-3-yl]ethanol.

Molecular Properties

Compound Name(2R)-2-amino-2-[5-(difluoromethyl)thiophen-3-yl]ethanol
PubChem CID130692072
Molecular FormulaC7H9F2NOS
Molecular Weight193.22 g/mol
Exact Mass193.04
IUPAC Name(2R)-2-amino-2-[5-(difluoromethyl)thiophen-3-yl]ethanol
SMILESN[C@@H](CO)c1csc(C(F)F)c1
InChIInChI=1S/C7H9F2NOS/c8-7(9)6-1-4(3-12-6)5(10)2-11/h1,3,5,7,11H,2,10H2/t5-/m0/s1
InChIKeyRUGCAAGDRGULAB-YFKPBYRVSA-N
XLogP1.68
TPSA46.25 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.22
LogP ≤ 51.68
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 (2R)-2-amino-2-[5-(difluoromethyl)thiophen-3-yl]ethanol?
The IUPAC name of (2R)-2-amino-2-[5-(difluoromethyl)thiophen-3-yl]ethanol (CID 130692072) is (2R)-2-amino-2-[5-(difluoromethyl)thiophen-3-yl]ethanol.
What is the SMILES notation for (2R)-2-amino-2-[5-(difluoromethyl)thiophen-3-yl]ethanol?
The canonical SMILES for (2R)-2-amino-2-[5-(difluoromethyl)thiophen-3-yl]ethanol is N[C@@H](CO)c1csc(C(F)F)c1.
What is the InChIKey of (2R)-2-amino-2-[5-(difluoromethyl)thiophen-3-yl]ethanol?
The InChIKey is RUGCAAGDRGULAB-YFKPBYRVSA-N. The full InChI is InChI=1S/C7H9F2NOS/c8-7(9)6-1-4(3-12-6)5(10)2-11/h1,3,5,7,11H,2,10H2/t5-/m0/s1.
What are the key properties of (2R)-2-amino-2-[5-(difluoromethyl)thiophen-3-yl]ethanol?
(2R)-2-amino-2-[5-(difluoromethyl)thiophen-3-yl]ethanol has a molecular weight of 193.22 g/mol, XLogP of 1.68, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-amino-2-[5-(difluoromethyl)thiophen-3-yl]ethanol is sourced from PubChem (CID 130692072), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).