2-amino-2-[2-(trifluoromethyl)phenyl]ethanol;methane

C10H14F3NO — CID 160725618

IUPAC2-amino-2-[2-(trifluoromethyl)phenyl]ethanol;methane
SMILESC.NC(CO)c1ccccc1C(F)(F)F
InChIInChI=1S/C9H10F3NO.CH4/c10-9(11,12)7-4-2-1-3-6(7)8(13)5-14;/h1-4,8,14H,5,13H2;1H4
InChIKeyRTRABFCHPUOYGI-UHFFFAOYSA-N
MW221.22 g/mol
LogP2.33
Rot. Bonds2

About 2-amino-2-[2-(trifluoromethyl)phenyl]ethanol;methane

2-amino-2-[2-(trifluoromethyl)phenyl]ethanol;methane (PubChem CID 160725618) has the molecular formula C10H14F3NO and a molecular weight of 221.22 g/mol. Its IUPAC name is 2-amino-2-[2-(trifluoromethyl)phenyl]ethanol;methane.

Molecular Properties

Compound Name2-amino-2-[2-(trifluoromethyl)phenyl]ethanol;methane
PubChem CID160725618
Molecular FormulaC10H14F3NO
Molecular Weight221.22 g/mol
Exact Mass221.10
IUPAC Name2-amino-2-[2-(trifluoromethyl)phenyl]ethanol;methane
SMILESC.NC(CO)c1ccccc1C(F)(F)F
InChIInChI=1S/C9H10F3NO.CH4/c10-9(11,12)7-4-2-1-3-6(7)8(13)5-14;/h1-4,8,14H,5,13H2;1H4
InChIKeyRTRABFCHPUOYGI-UHFFFAOYSA-N
XLogP2.33
TPSA46.25 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.22
LogP ≤ 52.33
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

(2S)-2-amino-2-[2-(trifluoromethyl)phenyl]ethanol
CID 66514163
2-amino-2-[2-(2-fluoropropan-2-yl)phenyl]ethanol
CID 84667706
2-[(1R)-1-amino-2-hydroxyethyl]-6-(trifluoromethyl)phenol
CID 66514473
(1S)-3,3,3-trifluoro-1-[2-(trifluoromethyl)phenyl]propan-1-amine
CID 103693880
1-[2-(trifluoromethyl)phenyl]propane-1,3-diamine
CID 13034547
(2S)-2-amino-2-[2,6-bis(trifluoromethyl)phenyl]ethanol
CID 66515831
3-[2-amino-2-[2-(trifluoromethyl)phenyl]ethyl]sulfanyl-2-methylpropan-1-ol
CID 107525319
(1S)-3,3-difluoro-1-[2-(trifluoromethyl)phenyl]propan-1-amine;hydrochloride
CID 171313078
(1R)-3,3-difluoro-1-[2-(trifluoromethyl)phenyl]propan-1-amine;hydrochloride
CID 171313711
(1S)-3-methyl-1-[2-(trifluoromethyl)phenyl]but-3-en-1-amine
CID 171226257
(1R)-3-methyl-1-[2-(trifluoromethyl)phenyl]but-3-en-1-amine
CID 171206682
(1S)-2-amino-1-[2-(trifluoromethyl)phenyl]ethanol
CID 40787149

Frequently Asked Questions

What is the IUPAC name of 2-amino-2-[2-(trifluoromethyl)phenyl]ethanol;methane?
The IUPAC name of 2-amino-2-[2-(trifluoromethyl)phenyl]ethanol;methane (CID 160725618) is 2-amino-2-[2-(trifluoromethyl)phenyl]ethanol;methane.
What is the SMILES notation for 2-amino-2-[2-(trifluoromethyl)phenyl]ethanol;methane?
The canonical SMILES for 2-amino-2-[2-(trifluoromethyl)phenyl]ethanol;methane is C.NC(CO)c1ccccc1C(F)(F)F.
What is the InChIKey of 2-amino-2-[2-(trifluoromethyl)phenyl]ethanol;methane?
The InChIKey is RTRABFCHPUOYGI-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10F3NO.CH4/c10-9(11,12)7-4-2-1-3-6(7)8(13)5-14;/h1-4,8,14H,5,13H2;1H4.
What are the key properties of 2-amino-2-[2-(trifluoromethyl)phenyl]ethanol;methane?
2-amino-2-[2-(trifluoromethyl)phenyl]ethanol;methane has a molecular weight of 221.22 g/mol, XLogP of 2.33, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-2-[2-(trifluoromethyl)phenyl]ethanol;methane is sourced from PubChem (CID 160725618), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).