1-(4-fluoro-2-morpholin-4-ylphenyl)ethanamine

C12H17FN2O — CID 66960314

IUPAC1-(4-fluoro-2-morpholin-4-ylphenyl)ethanamine
SMILESCC(N)c1ccc(F)cc1N1CCOCC1
InChIInChI=1S/C12H17FN2O/c1-9(14)11-3-2-10(13)8-12(11)15-4-6-16-7-5-15/h2-3,8-9H,4-7,14H2,1H3
InChIKeyMOIOOLRIELYRKO-UHFFFAOYSA-N
MW224.28 g/mol
LogP1.68
Rot. Bonds2

About 1-(4-fluoro-2-morpholin-4-ylphenyl)ethanamine

1-(4-fluoro-2-morpholin-4-ylphenyl)ethanamine (PubChem CID 66960314) has the molecular formula C12H17FN2O and a molecular weight of 224.28 g/mol. Its IUPAC name is 1-(4-fluoro-2-morpholin-4-ylphenyl)ethanamine.

Molecular Properties

Compound Name1-(4-fluoro-2-morpholin-4-ylphenyl)ethanamine
PubChem CID66960314
Molecular FormulaC12H17FN2O
Molecular Weight224.28 g/mol
Exact Mass224.13
IUPAC Name1-(4-fluoro-2-morpholin-4-ylphenyl)ethanamine
SMILESCC(N)c1ccc(F)cc1N1CCOCC1
InChIInChI=1S/C12H17FN2O/c1-9(14)11-3-2-10(13)8-12(11)15-4-6-16-7-5-15/h2-3,8-9H,4-7,14H2,1H3
InChIKeyMOIOOLRIELYRKO-UHFFFAOYSA-N
XLogP1.68
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.28
LogP ≤ 51.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-(Morpholinomethyl)aniline
CID 776851
4-(Morpholin-4-yl)-2-(trifluoromethyl)aniline
CID 822225
Benzenamine, 2-ethyl-N-[(1S)-2-methoxy-1-methylethyl]-6-methyl-
CID 10130489
(4-Methylbenzyl)(4-morpholin-4-ylphenyl)amine
CID 961186
(2-(Morpholin-4-yl)phenyl)methanamine
CID 2776563
4-(p-Tolyl)morpholine
CID 766255
4-Morpholinobenzylamine
CID 2776458
N-(2-methylphenyl)morpholine-4-carbothioamide
CID 700015
2-Fluoro-6-morpholinobenzonitrile
CID 654627
3-(2,4-difluorophenyl)-N-methyl-3-morpholin-4-ylpropan-1-amine
CID 54765676
N-(2-methylphenyl)piperidin-4-amine
CID 47002671
[3-Fluoro-4-(morpholin-4-yl)phenyl]methanamine
CID 11572017

Frequently Asked Questions

What is the IUPAC name of 1-(4-fluoro-2-morpholin-4-ylphenyl)ethanamine?
The IUPAC name of 1-(4-fluoro-2-morpholin-4-ylphenyl)ethanamine (CID 66960314) is 1-(4-fluoro-2-morpholin-4-ylphenyl)ethanamine.
What is the SMILES notation for 1-(4-fluoro-2-morpholin-4-ylphenyl)ethanamine?
The canonical SMILES for 1-(4-fluoro-2-morpholin-4-ylphenyl)ethanamine is CC(N)c1ccc(F)cc1N1CCOCC1.
What is the InChIKey of 1-(4-fluoro-2-morpholin-4-ylphenyl)ethanamine?
The InChIKey is MOIOOLRIELYRKO-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17FN2O/c1-9(14)11-3-2-10(13)8-12(11)15-4-6-16-7-5-15/h2-3,8-9H,4-7,14H2,1H3.
What are the key properties of 1-(4-fluoro-2-morpholin-4-ylphenyl)ethanamine?
1-(4-fluoro-2-morpholin-4-ylphenyl)ethanamine has a molecular weight of 224.28 g/mol, XLogP of 1.68, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-fluoro-2-morpholin-4-ylphenyl)ethanamine is sourced from PubChem (CID 66960314), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).