1-(2-fluorophenyl)-2-[2-hydroxyethyl(propyl)amino]ethanol

C13H20FNO2 — CID 56811844

IUPAC1-(2-fluorophenyl)-2-[2-hydroxyethyl(propyl)amino]ethanol
SMILESCCCN(CCO)CC(O)c1ccccc1F
InChIInChI=1S/C13H20FNO2/c1-2-7-15(8-9-16)10-13(17)11-5-3-4-6-12(11)14/h3-6,13,16-17H,2,7-10H2,1H3
InChIKeyUYHUWINIAGLJOP-UHFFFAOYSA-N
MW241.31 g/mol
LogP1.56
Rot. Bonds7

About 1-(2-fluorophenyl)-2-[2-hydroxyethyl(propyl)amino]ethanol

1-(2-fluorophenyl)-2-[2-hydroxyethyl(propyl)amino]ethanol (PubChem CID 56811844) has the molecular formula C13H20FNO2 and a molecular weight of 241.31 g/mol. Its IUPAC name is 1-(2-fluorophenyl)-2-[2-hydroxyethyl(propyl)amino]ethanol.

Molecular Properties

Compound Name1-(2-fluorophenyl)-2-[2-hydroxyethyl(propyl)amino]ethanol
PubChem CID56811844
Molecular FormulaC13H20FNO2
Molecular Weight241.31 g/mol
Exact Mass241.15
IUPAC Name1-(2-fluorophenyl)-2-[2-hydroxyethyl(propyl)amino]ethanol
SMILESCCCN(CCO)CC(O)c1ccccc1F
InChIInChI=1S/C13H20FNO2/c1-2-7-15(8-9-16)10-13(17)11-5-3-4-6-12(11)14/h3-6,13,16-17H,2,7-10H2,1H3
InChIKeyUYHUWINIAGLJOP-UHFFFAOYSA-N
XLogP1.56
TPSA43.70 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.31
LogP ≤ 51.56
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-(2-fluorophenyl)-2-[2-hydroxyethyl(2-methoxyethyl)amino]ethanol
CID 111103240
1-(2-fluorophenyl)-N',N'-dipropylethane-1,2-diamine
CID 16791201
1-(2,5-difluorophenyl)-2-[ethyl(2-hydroxyethyl)amino]ethanol
CID 82217059
2-[ethyl(2-methylprop-2-enyl)amino]-1-(2-fluorophenyl)ethanol
CID 110887728
3-(diethylamino)-1-(2-fluorophenyl)propan-1-ol
CID 62643876
1-(2-aminophenyl)-2-[ethyl(2-hydroxyethyl)amino]ethanol
CID 62266300
1-(2-fluorophenyl)-3-[2-hydroxyethyl(2,2,2-trifluoroethyl)amino]propan-1-ol
CID 107487213
2-[[3-amino-3-(2-fluorophenyl)-2-methylpropyl]-ethylamino]ethanol
CID 112679850
2-[bis(cyclopropylmethyl)amino]-1-(2-fluorophenyl)ethanol
CID 103670661
(1R)-2-[benzyl(2-hydroxyethyl)amino]-1-(2,5-difluorophenyl)ethanol
CID 94957732
1-(2,6-difluorophenyl)-2-[2-hydroxyethyl(2-methoxyethyl)amino]ethanol
CID 111103219
3-(dimethylamino)-1-(2-fluorophenyl)propan-1-ol
CID 62645456

Frequently Asked Questions

What is the IUPAC name of 1-(2-fluorophenyl)-2-[2-hydroxyethyl(propyl)amino]ethanol?
The IUPAC name of 1-(2-fluorophenyl)-2-[2-hydroxyethyl(propyl)amino]ethanol (CID 56811844) is 1-(2-fluorophenyl)-2-[2-hydroxyethyl(propyl)amino]ethanol.
What is the SMILES notation for 1-(2-fluorophenyl)-2-[2-hydroxyethyl(propyl)amino]ethanol?
The canonical SMILES for 1-(2-fluorophenyl)-2-[2-hydroxyethyl(propyl)amino]ethanol is CCCN(CCO)CC(O)c1ccccc1F.
What is the InChIKey of 1-(2-fluorophenyl)-2-[2-hydroxyethyl(propyl)amino]ethanol?
The InChIKey is UYHUWINIAGLJOP-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20FNO2/c1-2-7-15(8-9-16)10-13(17)11-5-3-4-6-12(11)14/h3-6,13,16-17H,2,7-10H2,1H3.
What are the key properties of 1-(2-fluorophenyl)-2-[2-hydroxyethyl(propyl)amino]ethanol?
1-(2-fluorophenyl)-2-[2-hydroxyethyl(propyl)amino]ethanol has a molecular weight of 241.31 g/mol, XLogP of 1.56, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-fluorophenyl)-2-[2-hydroxyethyl(propyl)amino]ethanol is sourced from PubChem (CID 56811844), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).