4-[fluoro(morpholin-4-yl)methyl]morpholine

C9H17FN2O2 — CID 25158601

IUPAC4-[fluoro(morpholin-4-yl)methyl]morpholine
SMILESFC(N1CCOCC1)N1CCOCC1
InChIInChI=1S/C9H17FN2O2/c10-9(11-1-5-13-6-2-11)12-3-7-14-8-4-12/h9H,1-8H2
InChIKeyASXGVNJCHMOWSM-UHFFFAOYSA-N
MW204.24 g/mol
LogP-0.10
Rot. Bonds2

About 4-[fluoro(morpholin-4-yl)methyl]morpholine

4-[fluoro(morpholin-4-yl)methyl]morpholine (PubChem CID 25158601) has the molecular formula C9H17FN2O2 and a molecular weight of 204.24 g/mol. Its IUPAC name is 4-[fluoro(morpholin-4-yl)methyl]morpholine.

Molecular Properties

Compound Name4-[fluoro(morpholin-4-yl)methyl]morpholine
PubChem CID25158601
Molecular FormulaC9H17FN2O2
Molecular Weight204.24 g/mol
Exact Mass204.13
IUPAC Name4-[fluoro(morpholin-4-yl)methyl]morpholine
SMILESFC(N1CCOCC1)N1CCOCC1
InChIInChI=1S/C9H17FN2O2/c10-9(11-1-5-13-6-2-11)12-3-7-14-8-4-12/h9H,1-8H2
InChIKeyASXGVNJCHMOWSM-UHFFFAOYSA-N
XLogP-0.10
TPSA24.94 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.24
LogP ≤ 5-0.10
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'N-C-halo', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 4-[fluoro(morpholin-4-yl)methyl]morpholine?
The IUPAC name of 4-[fluoro(morpholin-4-yl)methyl]morpholine (CID 25158601) is 4-[fluoro(morpholin-4-yl)methyl]morpholine.
What is the SMILES notation for 4-[fluoro(morpholin-4-yl)methyl]morpholine?
The canonical SMILES for 4-[fluoro(morpholin-4-yl)methyl]morpholine is FC(N1CCOCC1)N1CCOCC1.
What is the InChIKey of 4-[fluoro(morpholin-4-yl)methyl]morpholine?
The InChIKey is ASXGVNJCHMOWSM-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17FN2O2/c10-9(11-1-5-13-6-2-11)12-3-7-14-8-4-12/h9H,1-8H2.
What are the key properties of 4-[fluoro(morpholin-4-yl)methyl]morpholine?
4-[fluoro(morpholin-4-yl)methyl]morpholine has a molecular weight of 204.24 g/mol, XLogP of -0.10, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[fluoro(morpholin-4-yl)methyl]morpholine is sourced from PubChem (CID 25158601), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).