(2R)-2-amino-2-[3-(difluoromethyl)phenyl]ethanol

C9H11F2NO — CID 66514168

IUPAC(2R)-2-amino-2-[3-(difluoromethyl)phenyl]ethanol
SMILESN[C@@H](CO)c1cccc(C(F)F)c1
InChIInChI=1S/C9H11F2NO/c10-9(11)7-3-1-2-6(4-7)8(12)5-13/h1-4,8-9,13H,5,12H2/t8-/m0/s1
InChIKeyFDPKNYWHWBNAGG-QMMMGPOBSA-N
MW187.19 g/mol
LogP1.62
Rot. Bonds3

About (2R)-2-amino-2-[3-(difluoromethyl)phenyl]ethanol

(2R)-2-amino-2-[3-(difluoromethyl)phenyl]ethanol (PubChem CID 66514168) has the molecular formula C9H11F2NO and a molecular weight of 187.19 g/mol. Its IUPAC name is (2R)-2-amino-2-[3-(difluoromethyl)phenyl]ethanol.

Molecular Properties

Compound Name(2R)-2-amino-2-[3-(difluoromethyl)phenyl]ethanol
PubChem CID66514168
Molecular FormulaC9H11F2NO
Molecular Weight187.19 g/mol
Exact Mass187.08
IUPAC Name(2R)-2-amino-2-[3-(difluoromethyl)phenyl]ethanol
SMILESN[C@@H](CO)c1cccc(C(F)F)c1
InChIInChI=1S/C9H11F2NO/c10-9(11)7-3-1-2-6(4-7)8(12)5-13/h1-4,8-9,13H,5,12H2/t8-/m0/s1
InChIKeyFDPKNYWHWBNAGG-QMMMGPOBSA-N
XLogP1.62
TPSA46.25 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.19
LogP ≤ 51.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze (2R)-2-amino-2-[3-(difluoromethyl)phenyl]ethanol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(2S)-2-amino-2-(3-aminophenyl)ethanol
CID 66513825
3-amino-3-[3-(difluoromethyl)phenyl]propanenitrile
CID 55269014
2-amino-2-[3-(1,1-difluoro-2-methylpropyl)phenyl]ethanol
CID 116992715
2-amino-2-(3-phenylphenyl)ethanol
CID 77130058
(2R)-2-amino-2-(3-iodophenyl)ethanol;hydrochloride
CID 133268753
(2S)-2-amino-2-[3-(difluoromethyl)-4-fluorophenyl]ethanol
CID 66514177
(2R)-2-amino-2-[5-(difluoromethyl)-2-fluorophenyl]ethanol
CID 66514200
3-[(1S)-1-amino-2-hydroxyethyl]benzoic acid
CID 55278123
3-[(1R)-1-amino-2-hydroxyethyl]benzonitrile
CID 66513688
[3-(difluoromethyl)phenyl]methanediol
CID 162564421
(2R)-2-amino-2-[3-(dimethylamino)phenyl]ethanol;dihydrochloride
CID 146049704
2-[3-(difluoromethyl)phenyl]-2-(propan-2-ylamino)ethanol
CID 115528119

Frequently Asked Questions

What is the IUPAC name of (2R)-2-amino-2-[3-(difluoromethyl)phenyl]ethanol?
The IUPAC name of (2R)-2-amino-2-[3-(difluoromethyl)phenyl]ethanol (CID 66514168) is (2R)-2-amino-2-[3-(difluoromethyl)phenyl]ethanol.
What is the SMILES notation for (2R)-2-amino-2-[3-(difluoromethyl)phenyl]ethanol?
The canonical SMILES for (2R)-2-amino-2-[3-(difluoromethyl)phenyl]ethanol is N[C@@H](CO)c1cccc(C(F)F)c1.
What is the InChIKey of (2R)-2-amino-2-[3-(difluoromethyl)phenyl]ethanol?
The InChIKey is FDPKNYWHWBNAGG-QMMMGPOBSA-N. The full InChI is InChI=1S/C9H11F2NO/c10-9(11)7-3-1-2-6(4-7)8(12)5-13/h1-4,8-9,13H,5,12H2/t8-/m0/s1.
What are the key properties of (2R)-2-amino-2-[3-(difluoromethyl)phenyl]ethanol?
(2R)-2-amino-2-[3-(difluoromethyl)phenyl]ethanol has a molecular weight of 187.19 g/mol, XLogP of 1.62, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-amino-2-[3-(difluoromethyl)phenyl]ethanol is sourced from PubChem (CID 66514168), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).