2-(3-fluoro-4-morpholin-4-ylphenyl)ethanamine

C12H17FN2O — CID 63784903

IUPAC2-(3-fluoro-4-morpholin-4-ylphenyl)ethanamine
SMILESNCCc1ccc(N2CCOCC2)c(F)c1
InChIInChI=1S/C12H17FN2O/c13-11-9-10(3-4-14)1-2-12(11)15-5-7-16-8-6-15/h1-2,9H,3-8,14H2
InChIKeyJSZBKGXHHJOSCC-UHFFFAOYSA-N
MW224.28 g/mol
LogP1.16
Rot. Bonds3

About 2-(3-fluoro-4-morpholin-4-ylphenyl)ethanamine

2-(3-fluoro-4-morpholin-4-ylphenyl)ethanamine (PubChem CID 63784903) has the molecular formula C12H17FN2O and a molecular weight of 224.28 g/mol. Its IUPAC name is 2-(3-fluoro-4-morpholin-4-ylphenyl)ethanamine.

Molecular Properties

Compound Name2-(3-fluoro-4-morpholin-4-ylphenyl)ethanamine
PubChem CID63784903
Molecular FormulaC12H17FN2O
Molecular Weight224.28 g/mol
Exact Mass224.13
IUPAC Name2-(3-fluoro-4-morpholin-4-ylphenyl)ethanamine
SMILESNCCc1ccc(N2CCOCC2)c(F)c1
InChIInChI=1S/C12H17FN2O/c13-11-9-10(3-4-14)1-2-12(11)15-5-7-16-8-6-15/h1-2,9H,3-8,14H2
InChIKeyJSZBKGXHHJOSCC-UHFFFAOYSA-N
XLogP1.16
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.28
LogP ≤ 51.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

O-[2-(3-fluoro-4-morpholin-4-ylphenyl)ethyl]hydroxylamine
CID 117353426
2-[4-(1,1-dioxo-1,4-thiazinan-4-yl)-3-fluorophenyl]ethanamine
CID 63783750
2-(5-fluoro-2-morpholin-4-ylphenyl)ethanamine
CID 63784729
4-[4-(2-aminoethyl)-2-fluorophenyl]piperazine-1-carboxylic acid
CID 130302997
2-chloro-N-[2-(3-fluoro-4-morpholin-4-ylphenyl)ethyl]acetamide
CID 146106565
2-(4-morpholin-4-ylphenyl)ethanamine
CID 23009596
benzyl 3-(3-fluoro-4-morpholin-4-ylphenyl)propanoate
CID 145192081
1-[3-fluoro-4-(1,4-oxazepan-4-yl)phenyl]propan-2-amine
CID 63795074
CID 158409695
CID 158409695
2-[4-(1,4,7,10,13-pentaoxa-16-azacyclooctadec-16-yl)phenyl]ethanamine
CID 170868542
2-[4-(3,4-dimethoxypyrrolidin-1-yl)-3-fluorophenyl]ethanamine
CID 103540653
2-[(3-fluoro-4-morpholin-4-ylphenyl)methyl]-1,1,3,3-tetramethylguanidine
CID 111068321

Frequently Asked Questions

What is the IUPAC name of 2-(3-fluoro-4-morpholin-4-ylphenyl)ethanamine?
The IUPAC name of 2-(3-fluoro-4-morpholin-4-ylphenyl)ethanamine (CID 63784903) is 2-(3-fluoro-4-morpholin-4-ylphenyl)ethanamine.
What is the SMILES notation for 2-(3-fluoro-4-morpholin-4-ylphenyl)ethanamine?
The canonical SMILES for 2-(3-fluoro-4-morpholin-4-ylphenyl)ethanamine is NCCc1ccc(N2CCOCC2)c(F)c1.
What is the InChIKey of 2-(3-fluoro-4-morpholin-4-ylphenyl)ethanamine?
The InChIKey is JSZBKGXHHJOSCC-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17FN2O/c13-11-9-10(3-4-14)1-2-12(11)15-5-7-16-8-6-15/h1-2,9H,3-8,14H2.
What are the key properties of 2-(3-fluoro-4-morpholin-4-ylphenyl)ethanamine?
2-(3-fluoro-4-morpholin-4-ylphenyl)ethanamine has a molecular weight of 224.28 g/mol, XLogP of 1.16, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-fluoro-4-morpholin-4-ylphenyl)ethanamine is sourced from PubChem (CID 63784903), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).