2-amino-1,1-bis(3-fluorophenyl)ethanol

C14H13F2NO — CID 71663464

IUPAC2-amino-1,1-bis(3-fluorophenyl)ethanol
SMILESNCC(O)(c1cccc(F)c1)c1cccc(F)c1
InChIInChI=1S/C14H13F2NO/c15-12-5-1-3-10(7-12)14(18,9-17)11-4-2-6-13(16)8-11/h1-8,18H,9,17H2
InChIKeyRNJWGFKLUSLQEC-UHFFFAOYSA-N
MW249.26 g/mol
LogP2.16
Rot. Bonds3

About 2-amino-1,1-bis(3-fluorophenyl)ethanol

2-amino-1,1-bis(3-fluorophenyl)ethanol (PubChem CID 71663464) has the molecular formula C14H13F2NO and a molecular weight of 249.26 g/mol. Its IUPAC name is 2-amino-1,1-bis(3-fluorophenyl)ethanol.

Molecular Properties

Compound Name2-amino-1,1-bis(3-fluorophenyl)ethanol
PubChem CID71663464
Molecular FormulaC14H13F2NO
Molecular Weight249.26 g/mol
Exact Mass249.10
IUPAC Name2-amino-1,1-bis(3-fluorophenyl)ethanol
SMILESNCC(O)(c1cccc(F)c1)c1cccc(F)c1
InChIInChI=1S/C14H13F2NO/c15-12-5-1-3-10(7-12)14(18,9-17)11-4-2-6-13(16)8-11/h1-8,18H,9,17H2
InChIKeyRNJWGFKLUSLQEC-UHFFFAOYSA-N
XLogP2.16
TPSA46.25 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.26
LogP ≤ 52.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

1-(3-fluorophenyl)-1-[3-(trifluoromethyl)phenyl]propan-1-ol
CID 114872417
1-(4-ethylphenyl)-1-(3-fluorophenyl)propan-1-ol
CID 114872344
6-bromo-1,1-bis(3-fluorophenyl)hexan-1-ol
CID 135398253
1-bromo-1-(3-fluorophenyl)ethanol
CID 143635660
2-(3-fluorophenyl)-2-methylsulfanylpropan-1-amine
CID 82505976
(2S)-2-(3-fluorophenyl)pentan-2-ol
CID 93299056
1-[difluoro-(3-fluorophenyl)methyl]-3-fluorobenzene
CID 70952663
1-(2-amino-3-pyridinyl)-1-(3-fluorophenyl)propan-1-ol
CID 114872419
CID 59612023
CID 59612023
2-(3-fluorophenyl)-2-hydroxypropanamide
CID 62213418
2-(3-fluorophenyl)-2-methylpropane-1,3-diol
CID 79450508
1-(3-fluorophenyl)-1-(5-methylthiophen-3-yl)propan-1-ol
CID 114872384

Frequently Asked Questions

What is the IUPAC name of 2-amino-1,1-bis(3-fluorophenyl)ethanol?
The IUPAC name of 2-amino-1,1-bis(3-fluorophenyl)ethanol (CID 71663464) is 2-amino-1,1-bis(3-fluorophenyl)ethanol.
What is the SMILES notation for 2-amino-1,1-bis(3-fluorophenyl)ethanol?
The canonical SMILES for 2-amino-1,1-bis(3-fluorophenyl)ethanol is NCC(O)(c1cccc(F)c1)c1cccc(F)c1.
What is the InChIKey of 2-amino-1,1-bis(3-fluorophenyl)ethanol?
The InChIKey is RNJWGFKLUSLQEC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13F2NO/c15-12-5-1-3-10(7-12)14(18,9-17)11-4-2-6-13(16)8-11/h1-8,18H,9,17H2.
What are the key properties of 2-amino-1,1-bis(3-fluorophenyl)ethanol?
2-amino-1,1-bis(3-fluorophenyl)ethanol has a molecular weight of 249.26 g/mol, XLogP of 2.16, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-1,1-bis(3-fluorophenyl)ethanol is sourced from PubChem (CID 71663464), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).