2-(2,3-difluorophenyl)-2-(propan-2-ylamino)ethanol

C11H15F2NO — CID 63667424

IUPAC2-(2,3-difluorophenyl)-2-(propan-2-ylamino)ethanol
SMILESCC(C)NC(CO)c1cccc(F)c1F
InChIInChI=1S/C11H15F2NO/c1-7(2)14-10(6-15)8-4-3-5-9(12)11(8)13/h3-5,7,10,14-15H,6H2,1-2H3
InChIKeyCYFUMYJTICFWMU-UHFFFAOYSA-N
MW215.24 g/mol
LogP2.00
Rot. Bonds4

About 2-(2,3-difluorophenyl)-2-(propan-2-ylamino)ethanol

2-(2,3-difluorophenyl)-2-(propan-2-ylamino)ethanol (PubChem CID 63667424) has the molecular formula C11H15F2NO and a molecular weight of 215.24 g/mol. Its IUPAC name is 2-(2,3-difluorophenyl)-2-(propan-2-ylamino)ethanol.

Molecular Properties

Compound Name2-(2,3-difluorophenyl)-2-(propan-2-ylamino)ethanol
PubChem CID63667424
Molecular FormulaC11H15F2NO
Molecular Weight215.24 g/mol
Exact Mass215.11
IUPAC Name2-(2,3-difluorophenyl)-2-(propan-2-ylamino)ethanol
SMILESCC(C)NC(CO)c1cccc(F)c1F
InChIInChI=1S/C11H15F2NO/c1-7(2)14-10(6-15)8-4-3-5-9(12)11(8)13/h3-5,7,10,14-15H,6H2,1-2H3
InChIKeyCYFUMYJTICFWMU-UHFFFAOYSA-N
XLogP2.00
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.24
LogP ≤ 52.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-(2,3-difluorophenyl)-2-(2-methylpropylamino)ethanol
CID 63667429
(2R)-2-(3-bromo-2-fluorophenyl)-2-(methylamino)ethanol
CID 131031091
2-(2,3-difluorophenyl)-2-(3-fluoro-5-methylanilino)ethanol
CID 79049466
2-(3-chloro-2-fluorophenyl)-2-(methylamino)ethanol
CID 112704196
(2R)-2-(2-chloro-3-fluorophenyl)-2-(methylamino)ethanol
CID 130642132
(2R)-2-(3-chloro-2-fluorophenyl)-2-(methylamino)ethanol
CID 130706318
1-[1-(2,3-difluorophenyl)ethyl]-3-[(1S)-2-hydroxy-1-phenylethyl]urea
CID 75517893
2-(propan-2-ylamino)-2-quinolin-8-ylethanol
CID 63968321
(2S)-2-amino-2-(2,3-difluorophenyl)ethanol;hydrochloride
CID 171204156
(2R)-2-[[(1S)-1-(3-chloro-2-fluorophenyl)propyl]amino]propan-1-ol
CID 99636952
[1-[[1-(2,3-difluorophenyl)ethylamino]methyl]cyclohexyl]methanol
CID 103924886
N-[1-(2,3-difluorophenyl)ethyl]-3-methylbutan-2-amine
CID 115897219

Frequently Asked Questions

What is the IUPAC name of 2-(2,3-difluorophenyl)-2-(propan-2-ylamino)ethanol?
The IUPAC name of 2-(2,3-difluorophenyl)-2-(propan-2-ylamino)ethanol (CID 63667424) is 2-(2,3-difluorophenyl)-2-(propan-2-ylamino)ethanol.
What is the SMILES notation for 2-(2,3-difluorophenyl)-2-(propan-2-ylamino)ethanol?
The canonical SMILES for 2-(2,3-difluorophenyl)-2-(propan-2-ylamino)ethanol is CC(C)NC(CO)c1cccc(F)c1F.
What is the InChIKey of 2-(2,3-difluorophenyl)-2-(propan-2-ylamino)ethanol?
The InChIKey is CYFUMYJTICFWMU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15F2NO/c1-7(2)14-10(6-15)8-4-3-5-9(12)11(8)13/h3-5,7,10,14-15H,6H2,1-2H3.
What are the key properties of 2-(2,3-difluorophenyl)-2-(propan-2-ylamino)ethanol?
2-(2,3-difluorophenyl)-2-(propan-2-ylamino)ethanol has a molecular weight of 215.24 g/mol, XLogP of 2.00, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,3-difluorophenyl)-2-(propan-2-ylamino)ethanol is sourced from PubChem (CID 63667424), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).