2-[4-[1-(4-fluorophenyl)ethylamino]phenyl]ethanol

C16H18FNO — CID 61236407

IUPAC2-[4-[1-(4-fluorophenyl)ethylamino]phenyl]ethanol
SMILESCC(Nc1ccc(CCO)cc1)c1ccc(F)cc1
InChIInChI=1S/C16H18FNO/c1-12(14-4-6-15(17)7-5-14)18-16-8-2-13(3-9-16)10-11-19/h2-9,12,18-19H,10-11H2,1H3
InChIKeyWMPFSEIJOGHSNB-UHFFFAOYSA-N
MW259.32 g/mol
LogP3.53
Rot. Bonds5

About 2-[4-[1-(4-fluorophenyl)ethylamino]phenyl]ethanol

2-[4-[1-(4-fluorophenyl)ethylamino]phenyl]ethanol (PubChem CID 61236407) has the molecular formula C16H18FNO and a molecular weight of 259.32 g/mol. Its IUPAC name is 2-[4-[1-(4-fluorophenyl)ethylamino]phenyl]ethanol.

Molecular Properties

Compound Name2-[4-[1-(4-fluorophenyl)ethylamino]phenyl]ethanol
PubChem CID61236407
Molecular FormulaC16H18FNO
Molecular Weight259.32 g/mol
Exact Mass259.14
IUPAC Name2-[4-[1-(4-fluorophenyl)ethylamino]phenyl]ethanol
SMILESCC(Nc1ccc(CCO)cc1)c1ccc(F)cc1
InChIInChI=1S/C16H18FNO/c1-12(14-4-6-15(17)7-5-14)18-16-8-2-13(3-9-16)10-11-19/h2-9,12,18-19H,10-11H2,1H3
InChIKeyWMPFSEIJOGHSNB-UHFFFAOYSA-N
XLogP3.53
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.32
LogP ≤ 53.53
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-[4-[1-(4-propan-2-ylphenyl)ethylamino]phenyl]ethanol
CID 61236945
2-[4-[1-(4-methylphenyl)ethylamino]phenyl]ethanol
CID 61238927
4-fluoro-N-[1-(4-propylphenyl)ethyl]aniline
CID 43094286
2-[4-[1-[4-(dimethylamino)phenyl]ethylamino]phenyl]ethanol
CID 61238255
2-[4-[1-(3-bromo-4-fluorophenyl)ethylamino]phenyl]ethanol
CID 61236609
2-[4-[1-(4-ethoxyphenyl)ethylamino]phenyl]ethanol
CID 61236951
2-[4-[1-(2,6-difluorophenyl)ethylamino]phenyl]ethanol
CID 61236588
4-[1-[4-(2-hydroxyethyl)anilino]ethyl]-N,N-dimethylbenzenesulfonamide
CID 110907925
N-[1-(4-fluorophenyl)ethyl]-4-methylaniline
CID 43179245
N-[1-(4-fluorophenyl)ethyl]-4-iodoaniline
CID 43088233
4-methyl-N-[1-(4-propylphenyl)ethyl]aniline
CID 43111793
[4-(1-phenylethylamino)phenyl]methanol
CID 112706513

Frequently Asked Questions

What is the IUPAC name of 2-[4-[1-(4-fluorophenyl)ethylamino]phenyl]ethanol?
The IUPAC name of 2-[4-[1-(4-fluorophenyl)ethylamino]phenyl]ethanol (CID 61236407) is 2-[4-[1-(4-fluorophenyl)ethylamino]phenyl]ethanol.
What is the SMILES notation for 2-[4-[1-(4-fluorophenyl)ethylamino]phenyl]ethanol?
The canonical SMILES for 2-[4-[1-(4-fluorophenyl)ethylamino]phenyl]ethanol is CC(Nc1ccc(CCO)cc1)c1ccc(F)cc1.
What is the InChIKey of 2-[4-[1-(4-fluorophenyl)ethylamino]phenyl]ethanol?
The InChIKey is WMPFSEIJOGHSNB-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18FNO/c1-12(14-4-6-15(17)7-5-14)18-16-8-2-13(3-9-16)10-11-19/h2-9,12,18-19H,10-11H2,1H3.
What are the key properties of 2-[4-[1-(4-fluorophenyl)ethylamino]phenyl]ethanol?
2-[4-[1-(4-fluorophenyl)ethylamino]phenyl]ethanol has a molecular weight of 259.32 g/mol, XLogP of 3.53, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-[1-(4-fluorophenyl)ethylamino]phenyl]ethanol is sourced from PubChem (CID 61236407), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).