2-[2-(2-fluorophenyl)morpholin-4-yl]ethanamine

C12H17FN2O — CID 82024344

IUPAC2-[2-(2-fluorophenyl)morpholin-4-yl]ethanamine
SMILESNCCN1CCOC(c2ccccc2F)C1
InChIInChI=1S/C12H17FN2O/c13-11-4-2-1-3-10(11)12-9-15(6-5-14)7-8-16-12/h1-4,12H,5-9,14H2
InChIKeyJNVBOLOOCPLLFD-UHFFFAOYSA-N
MW224.28 g/mol
LogP1.16
Rot. Bonds3

About 2-[2-(2-fluorophenyl)morpholin-4-yl]ethanamine

2-[2-(2-fluorophenyl)morpholin-4-yl]ethanamine (PubChem CID 82024344) has the molecular formula C12H17FN2O and a molecular weight of 224.28 g/mol. Its IUPAC name is 2-[2-(2-fluorophenyl)morpholin-4-yl]ethanamine.

Molecular Properties

Compound Name2-[2-(2-fluorophenyl)morpholin-4-yl]ethanamine
PubChem CID82024344
Molecular FormulaC12H17FN2O
Molecular Weight224.28 g/mol
Exact Mass224.13
IUPAC Name2-[2-(2-fluorophenyl)morpholin-4-yl]ethanamine
SMILESNCCN1CCOC(c2ccccc2F)C1
InChIInChI=1S/C12H17FN2O/c13-11-4-2-1-3-10(11)12-9-15(6-5-14)7-8-16-12/h1-4,12H,5-9,14H2
InChIKeyJNVBOLOOCPLLFD-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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Frequently Asked Questions

What is the IUPAC name of 2-[2-(2-fluorophenyl)morpholin-4-yl]ethanamine?
The IUPAC name of 2-[2-(2-fluorophenyl)morpholin-4-yl]ethanamine (CID 82024344) is 2-[2-(2-fluorophenyl)morpholin-4-yl]ethanamine.
What is the SMILES notation for 2-[2-(2-fluorophenyl)morpholin-4-yl]ethanamine?
The canonical SMILES for 2-[2-(2-fluorophenyl)morpholin-4-yl]ethanamine is NCCN1CCOC(c2ccccc2F)C1.
What is the InChIKey of 2-[2-(2-fluorophenyl)morpholin-4-yl]ethanamine?
The InChIKey is JNVBOLOOCPLLFD-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17FN2O/c13-11-4-2-1-3-10(11)12-9-15(6-5-14)7-8-16-12/h1-4,12H,5-9,14H2.
What are the key properties of 2-[2-(2-fluorophenyl)morpholin-4-yl]ethanamine?
2-[2-(2-fluorophenyl)morpholin-4-yl]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-[2-(2-fluorophenyl)morpholin-4-yl]ethanamine is sourced from PubChem (CID 82024344), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).