2-(3-fluoroanilino)-2-(2-fluorophenyl)ethanol

C14H13F2NO — CID 61048110

IUPAC2-(3-fluoroanilino)-2-(2-fluorophenyl)ethanol
SMILESOCC(Nc1cccc(F)c1)c1ccccc1F
InChIInChI=1S/C14H13F2NO/c15-10-4-3-5-11(8-10)17-14(9-18)12-6-1-2-7-13(12)16/h1-8,14,17-18H,9H2
InChIKeyFWGWCCSBUFGIGE-UHFFFAOYSA-N
MW249.26 g/mol
LogP3.11
Rot. Bonds4

About 2-(3-fluoroanilino)-2-(2-fluorophenyl)ethanol

2-(3-fluoroanilino)-2-(2-fluorophenyl)ethanol (PubChem CID 61048110) has the molecular formula C14H13F2NO and a molecular weight of 249.26 g/mol. Its IUPAC name is 2-(3-fluoroanilino)-2-(2-fluorophenyl)ethanol.

Molecular Properties

Compound Name2-(3-fluoroanilino)-2-(2-fluorophenyl)ethanol
PubChem CID61048110
Molecular FormulaC14H13F2NO
Molecular Weight249.26 g/mol
Exact Mass249.10
IUPAC Name2-(3-fluoroanilino)-2-(2-fluorophenyl)ethanol
SMILESOCC(Nc1cccc(F)c1)c1ccccc1F
InChIInChI=1S/C14H13F2NO/c15-10-4-3-5-11(8-10)17-14(9-18)12-6-1-2-7-13(12)16/h1-8,14,17-18H,9H2
InChIKeyFWGWCCSBUFGIGE-UHFFFAOYSA-N
XLogP3.11
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.26
LogP ≤ 53.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-(2-fluorophenyl)-2-(3-methylanilino)ethanol
CID 61050184
2-[2-(difluoromethoxy)phenyl]-2-(3-fluoroanilino)ethanol
CID 61048896
2-(2,3-difluorophenyl)-2-(3-fluoro-5-methylanilino)ethanol
CID 79049466
2-(3-fluoroanilino)-2-(2-fluorophenyl)acetic acid
CID 54890173
2-(4-bromo-3-fluorophenyl)-2-(3-fluoroanilino)ethanol
CID 81440489
2-(3-bromoanilino)-2-(5-bromo-2-fluorophenyl)ethanol
CID 61050655
2-(3-bromophenyl)-2-(3-fluoroanilino)ethanol
CID 61048900
ethyl 2-(3-fluoroanilino)-2-(2-fluorophenyl)acetate
CID 60993455
2-(2-chlorophenyl)-2-(3-fluoro-5-methylanilino)ethanol
CID 79049315
1-(4-bromo-2-fluorophenyl)-N-(3-fluorophenyl)ethane-1,2-diamine
CID 65383822
2-(3-chloroanilino)-2-(4-fluoro-2-methylphenyl)ethanol
CID 55038676
2-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-(3-fluoroanilino)ethanol
CID 61048704

Frequently Asked Questions

What is the IUPAC name of 2-(3-fluoroanilino)-2-(2-fluorophenyl)ethanol?
The IUPAC name of 2-(3-fluoroanilino)-2-(2-fluorophenyl)ethanol (CID 61048110) is 2-(3-fluoroanilino)-2-(2-fluorophenyl)ethanol.
What is the SMILES notation for 2-(3-fluoroanilino)-2-(2-fluorophenyl)ethanol?
The canonical SMILES for 2-(3-fluoroanilino)-2-(2-fluorophenyl)ethanol is OCC(Nc1cccc(F)c1)c1ccccc1F.
What is the InChIKey of 2-(3-fluoroanilino)-2-(2-fluorophenyl)ethanol?
The InChIKey is FWGWCCSBUFGIGE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13F2NO/c15-10-4-3-5-11(8-10)17-14(9-18)12-6-1-2-7-13(12)16/h1-8,14,17-18H,9H2.
What are the key properties of 2-(3-fluoroanilino)-2-(2-fluorophenyl)ethanol?
2-(3-fluoroanilino)-2-(2-fluorophenyl)ethanol has a molecular weight of 249.26 g/mol, XLogP of 3.11, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-fluoroanilino)-2-(2-fluorophenyl)ethanol is sourced from PubChem (CID 61048110), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).