2-[2-(2-fluorophenyl)ethylamino]-2-phenylethanol

C16H18FNO — CID 110012007

IUPAC2-[2-(2-fluorophenyl)ethylamino]-2-phenylethanol
SMILESOCC(NCCc1ccccc1F)c1ccccc1
InChIInChI=1S/C16H18FNO/c17-15-9-5-4-6-13(15)10-11-18-16(12-19)14-7-2-1-3-8-14/h1-9,16,18-19H,10-12H2
InChIKeyKKHXQJCBXSLHPG-UHFFFAOYSA-N
MW259.32 g/mol
LogP2.69
Rot. Bonds6

About 2-[2-(2-fluorophenyl)ethylamino]-2-phenylethanol

2-[2-(2-fluorophenyl)ethylamino]-2-phenylethanol (PubChem CID 110012007) has the molecular formula C16H18FNO and a molecular weight of 259.32 g/mol. Its IUPAC name is 2-[2-(2-fluorophenyl)ethylamino]-2-phenylethanol.

Molecular Properties

Compound Name2-[2-(2-fluorophenyl)ethylamino]-2-phenylethanol
PubChem CID110012007
Molecular FormulaC16H18FNO
Molecular Weight259.32 g/mol
Exact Mass259.14
IUPAC Name2-[2-(2-fluorophenyl)ethylamino]-2-phenylethanol
SMILESOCC(NCCc1ccccc1F)c1ccccc1
InChIInChI=1S/C16H18FNO/c17-15-9-5-4-6-13(15)10-11-18-16(12-19)14-7-2-1-3-8-14/h1-9,16,18-19H,10-12H2
InChIKeyKKHXQJCBXSLHPG-UHFFFAOYSA-N
XLogP2.69
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.32
LogP ≤ 52.69
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-[2-(2-fluorophenyl)ethyl]-1-phenylbutan-1-amine
CID 43108094
1-[2-(2-fluorophenyl)ethyl]-3-(2-hydroxy-1-phenylethyl)urea
CID 110895025
2-[2-(2-fluorophenyl)ethylamino]-3-methylbutan-1-ol
CID 115137737
N-ethyl-3-(2-fluorophenyl)-1-phenylpropan-1-amine
CID 54891295
(2R)-2-(3-fluorophenyl)-2-(2-phenylethylamino)ethanol
CID 124885583
4-[(2-hydroxy-1-phenylethyl)amino]butan-1-ol
CID 63183327
2-(2-methoxyethylamino)-2-phenylethanol
CID 62544769
(2R)-2-(but-3-enylamino)-2-phenylethanol
CID 14716014
2-[(4-chloro-2-fluorophenyl)methylamino]-2-phenylethanol
CID 114750493
1-benzhydryl-3-[2-(2-fluorophenyl)ethyl]urea
CID 41304292
1-(3,4-dichlorophenyl)-N-[2-(2-fluorophenyl)ethyl]propan-1-amine
CID 43760641
2-[(2-bromophenyl)methylamino]-2-phenylethanol
CID 6613037

Frequently Asked Questions

What is the IUPAC name of 2-[2-(2-fluorophenyl)ethylamino]-2-phenylethanol?
The IUPAC name of 2-[2-(2-fluorophenyl)ethylamino]-2-phenylethanol (CID 110012007) is 2-[2-(2-fluorophenyl)ethylamino]-2-phenylethanol.
What is the SMILES notation for 2-[2-(2-fluorophenyl)ethylamino]-2-phenylethanol?
The canonical SMILES for 2-[2-(2-fluorophenyl)ethylamino]-2-phenylethanol is OCC(NCCc1ccccc1F)c1ccccc1.
What is the InChIKey of 2-[2-(2-fluorophenyl)ethylamino]-2-phenylethanol?
The InChIKey is KKHXQJCBXSLHPG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18FNO/c17-15-9-5-4-6-13(15)10-11-18-16(12-19)14-7-2-1-3-8-14/h1-9,16,18-19H,10-12H2.
What are the key properties of 2-[2-(2-fluorophenyl)ethylamino]-2-phenylethanol?
2-[2-(2-fluorophenyl)ethylamino]-2-phenylethanol has a molecular weight of 259.32 g/mol, XLogP of 2.69, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(2-fluorophenyl)ethylamino]-2-phenylethanol is sourced from PubChem (CID 110012007), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).