(2R)-2-amino-2-[4-(trifluoromethyl)phenyl]ethanol

C9H10F3NO — CID 10512424

IUPAC(2R)-2-amino-2-[4-(trifluoromethyl)phenyl]ethanol
SMILESN[C@@H](CO)c1ccc(C(F)(F)F)cc1
InChIInChI=1S/C9H10F3NO/c10-9(11,12)7-3-1-6(2-4-7)8(13)5-14/h1-4,8,14H,5,13H2/t8-/m0/s1
InChIKeyVDJAPRZLEXCFHF-QMMMGPOBSA-N
MW205.18 g/mol
LogP1.70
Rot. Bonds2

About (2R)-2-amino-2-[4-(trifluoromethyl)phenyl]ethanol

(2R)-2-amino-2-[4-(trifluoromethyl)phenyl]ethanol (PubChem CID 10512424) has the molecular formula C9H10F3NO and a molecular weight of 205.18 g/mol. Its IUPAC name is (2R)-2-amino-2-[4-(trifluoromethyl)phenyl]ethanol.

Molecular Properties

Compound Name(2R)-2-amino-2-[4-(trifluoromethyl)phenyl]ethanol
PubChem CID10512424
Molecular FormulaC9H10F3NO
Molecular Weight205.18 g/mol
Exact Mass205.07
IUPAC Name(2R)-2-amino-2-[4-(trifluoromethyl)phenyl]ethanol
SMILESN[C@@H](CO)c1ccc(C(F)(F)F)cc1
InChIInChI=1S/C9H10F3NO/c10-9(11,12)7-3-1-6(2-4-7)8(13)5-14/h1-4,8,14H,5,13H2/t8-/m0/s1
InChIKeyVDJAPRZLEXCFHF-QMMMGPOBSA-N
XLogP1.70
TPSA46.25 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.18
LogP ≤ 51.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (2R)-2-amino-2-[4-(trifluoromethyl)phenyl]ethanol?
The IUPAC name of (2R)-2-amino-2-[4-(trifluoromethyl)phenyl]ethanol (CID 10512424) is (2R)-2-amino-2-[4-(trifluoromethyl)phenyl]ethanol.
What is the SMILES notation for (2R)-2-amino-2-[4-(trifluoromethyl)phenyl]ethanol?
The canonical SMILES for (2R)-2-amino-2-[4-(trifluoromethyl)phenyl]ethanol is N[C@@H](CO)c1ccc(C(F)(F)F)cc1.
What is the InChIKey of (2R)-2-amino-2-[4-(trifluoromethyl)phenyl]ethanol?
The InChIKey is VDJAPRZLEXCFHF-QMMMGPOBSA-N. The full InChI is InChI=1S/C9H10F3NO/c10-9(11,12)7-3-1-6(2-4-7)8(13)5-14/h1-4,8,14H,5,13H2/t8-/m0/s1.
What are the key properties of (2R)-2-amino-2-[4-(trifluoromethyl)phenyl]ethanol?
(2R)-2-amino-2-[4-(trifluoromethyl)phenyl]ethanol has a molecular weight of 205.18 g/mol, XLogP of 1.70, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-amino-2-[4-(trifluoromethyl)phenyl]ethanol is sourced from PubChem (CID 10512424), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).