2-anilino-1-(2,5-difluorophenyl)ethanol

C14H13F2NO — CID 55026297

IUPAC2-anilino-1-(2,5-difluorophenyl)ethanol
SMILESOC(CNc1ccccc1)c1cc(F)ccc1F
InChIInChI=1S/C14H13F2NO/c15-10-6-7-13(16)12(8-10)14(18)9-17-11-4-2-1-3-5-11/h1-8,14,17-18H,9H2
InChIKeyOWVUDSVGOGVEDI-UHFFFAOYSA-N
MW249.26 g/mol
LogP3.11
Rot. Bonds4

About 2-anilino-1-(2,5-difluorophenyl)ethanol

2-anilino-1-(2,5-difluorophenyl)ethanol (PubChem CID 55026297) has the molecular formula C14H13F2NO and a molecular weight of 249.26 g/mol. Its IUPAC name is 2-anilino-1-(2,5-difluorophenyl)ethanol.

Molecular Properties

Compound Name2-anilino-1-(2,5-difluorophenyl)ethanol
PubChem CID55026297
Molecular FormulaC14H13F2NO
Molecular Weight249.26 g/mol
Exact Mass249.10
IUPAC Name2-anilino-1-(2,5-difluorophenyl)ethanol
SMILESOC(CNc1ccccc1)c1cc(F)ccc1F
InChIInChI=1S/C14H13F2NO/c15-10-6-7-13(16)12(8-10)14(18)9-17-11-4-2-1-3-5-11/h1-8,14,17-18H,9H2
InChIKeyOWVUDSVGOGVEDI-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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Frequently Asked Questions

What is the IUPAC name of 2-anilino-1-(2,5-difluorophenyl)ethanol?
The IUPAC name of 2-anilino-1-(2,5-difluorophenyl)ethanol (CID 55026297) is 2-anilino-1-(2,5-difluorophenyl)ethanol.
What is the SMILES notation for 2-anilino-1-(2,5-difluorophenyl)ethanol?
The canonical SMILES for 2-anilino-1-(2,5-difluorophenyl)ethanol is OC(CNc1ccccc1)c1cc(F)ccc1F.
What is the InChIKey of 2-anilino-1-(2,5-difluorophenyl)ethanol?
The InChIKey is OWVUDSVGOGVEDI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13F2NO/c15-10-6-7-13(16)12(8-10)14(18)9-17-11-4-2-1-3-5-11/h1-8,14,17-18H,9H2.
What are the key properties of 2-anilino-1-(2,5-difluorophenyl)ethanol?
2-anilino-1-(2,5-difluorophenyl)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-anilino-1-(2,5-difluorophenyl)ethanol is sourced from PubChem (CID 55026297), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).