1-(4-fluorophenyl)-2-[(4-methylmorpholin-2-yl)methylamino]ethanol

C14H21FN2O2 — CID 78945331

IUPAC1-(4-fluorophenyl)-2-[(4-methylmorpholin-2-yl)methylamino]ethanol
SMILESCN1CCOC(CNCC(O)c2ccc(F)cc2)C1
InChIInChI=1S/C14H21FN2O2/c1-17-6-7-19-13(10-17)8-16-9-14(18)11-2-4-12(15)5-3-11/h2-5,13-14,16,18H,6-10H2,1H3
InChIKeyYPTLKFUIUXDGEJ-UHFFFAOYSA-N
MW268.33 g/mol
LogP0.78
Rot. Bonds5

About 1-(4-fluorophenyl)-2-[(4-methylmorpholin-2-yl)methylamino]ethanol

1-(4-fluorophenyl)-2-[(4-methylmorpholin-2-yl)methylamino]ethanol (PubChem CID 78945331) has the molecular formula C14H21FN2O2 and a molecular weight of 268.33 g/mol. Its IUPAC name is 1-(4-fluorophenyl)-2-[(4-methylmorpholin-2-yl)methylamino]ethanol.

Molecular Properties

Compound Name1-(4-fluorophenyl)-2-[(4-methylmorpholin-2-yl)methylamino]ethanol
PubChem CID78945331
Molecular FormulaC14H21FN2O2
Molecular Weight268.33 g/mol
Exact Mass268.16
IUPAC Name1-(4-fluorophenyl)-2-[(4-methylmorpholin-2-yl)methylamino]ethanol
SMILESCN1CCOC(CNCC(O)c2ccc(F)cc2)C1
InChIInChI=1S/C14H21FN2O2/c1-17-6-7-19-13(10-17)8-16-9-14(18)11-2-4-12(15)5-3-11/h2-5,13-14,16,18H,6-10H2,1H3
InChIKeyYPTLKFUIUXDGEJ-UHFFFAOYSA-N
XLogP0.78
TPSA44.73 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.33
LogP ≤ 50.78
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

(1R)-1-(4-bromophenyl)-2-[[(2R)-4-methylmorpholin-2-yl]methylamino]ethanol
CID 95751208
(1S)-2-[[(2S)-4-methylmorpholin-2-yl]methylamino]-1-[4-(trifluoromethoxy)phenyl]ethanol
CID 98758883
1-(4-fluorophenyl)-N-[(4-methylmorpholin-2-yl)methyl]propan-1-amine
CID 78997863
1-[(1R)-1-(4-fluorophenyl)ethyl]-3-[(4-methylmorpholin-2-yl)methyl]urea
CID 138010008
4-[[[2-(4-fluorophenyl)-2-hydroxyethyl]amino]methyl]cyclohexan-1-ol
CID 106133374
2-ethyl-N-[[(2S)-4-methylmorpholin-2-yl]methyl]butan-1-amine
CID 97045075
2,2-dicyclopropyl-N-[(4-methylmorpholin-2-yl)methyl]ethanamine
CID 79172002
N-[(2-bromo-4-fluorophenyl)methyl]-1-[(2R)-4-methylmorpholin-2-yl]methanamine
CID 95758037
1-[(4-methylmorpholin-2-yl)methylamino]-3-pyrrolidin-1-ylpropan-2-ol
CID 78945365
2-methyl-N-[(4-methylmorpholin-2-yl)methyl]butan-1-amine
CID 75356165
(2S)-1-[[(2R)-4-methylmorpholin-2-yl]methylamino]-3-phenylmethoxypropan-2-ol
CID 95751212
1-(4-fluorophenyl)-2-[(3-methylcyclopentyl)methylamino]ethanol
CID 107412879

Frequently Asked Questions

What is the IUPAC name of 1-(4-fluorophenyl)-2-[(4-methylmorpholin-2-yl)methylamino]ethanol?
The IUPAC name of 1-(4-fluorophenyl)-2-[(4-methylmorpholin-2-yl)methylamino]ethanol (CID 78945331) is 1-(4-fluorophenyl)-2-[(4-methylmorpholin-2-yl)methylamino]ethanol.
What is the SMILES notation for 1-(4-fluorophenyl)-2-[(4-methylmorpholin-2-yl)methylamino]ethanol?
The canonical SMILES for 1-(4-fluorophenyl)-2-[(4-methylmorpholin-2-yl)methylamino]ethanol is CN1CCOC(CNCC(O)c2ccc(F)cc2)C1.
What is the InChIKey of 1-(4-fluorophenyl)-2-[(4-methylmorpholin-2-yl)methylamino]ethanol?
The InChIKey is YPTLKFUIUXDGEJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21FN2O2/c1-17-6-7-19-13(10-17)8-16-9-14(18)11-2-4-12(15)5-3-11/h2-5,13-14,16,18H,6-10H2,1H3.
What are the key properties of 1-(4-fluorophenyl)-2-[(4-methylmorpholin-2-yl)methylamino]ethanol?
1-(4-fluorophenyl)-2-[(4-methylmorpholin-2-yl)methylamino]ethanol has a molecular weight of 268.33 g/mol, XLogP of 0.78, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-fluorophenyl)-2-[(4-methylmorpholin-2-yl)methylamino]ethanol is sourced from PubChem (CID 78945331), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).