4-[(E)-2-fluoro-1-pyrrolidin-1-ylethenyl]morpholine

C10H17FN2O — CID 135169406

IUPAC4-[(E)-2-fluoro-1-pyrrolidin-1-ylethenyl]morpholine
SMILESF/C=C(\N1CCCC1)N1CCOCC1
InChIInChI=1S/C10H17FN2O/c11-9-10(12-3-1-2-4-12)13-5-7-14-8-6-13/h9H,1-8H2/b10-9+
InChIKeyXYRNUPHBOCTULZ-MDZDMXLPSA-N
MW200.26 g/mol
LogP1.18
Rot. Bonds2

About 4-[(E)-2-fluoro-1-pyrrolidin-1-ylethenyl]morpholine

4-[(E)-2-fluoro-1-pyrrolidin-1-ylethenyl]morpholine (PubChem CID 135169406) has the molecular formula C10H17FN2O and a molecular weight of 200.26 g/mol. Its IUPAC name is 4-[(E)-2-fluoro-1-pyrrolidin-1-ylethenyl]morpholine.

Molecular Properties

Compound Name4-[(E)-2-fluoro-1-pyrrolidin-1-ylethenyl]morpholine
PubChem CID135169406
Molecular FormulaC10H17FN2O
Molecular Weight200.26 g/mol
Exact Mass200.13
IUPAC Name4-[(E)-2-fluoro-1-pyrrolidin-1-ylethenyl]morpholine
SMILESF/C=C(\N1CCCC1)N1CCOCC1
InChIInChI=1S/C10H17FN2O/c11-9-10(12-3-1-2-4-12)13-5-7-14-8-6-13/h9H,1-8H2/b10-9+
InChIKeyXYRNUPHBOCTULZ-MDZDMXLPSA-N
XLogP1.18
TPSA15.71 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.26
LogP ≤ 51.18
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-[(E)-2-fluoro-1-pyrrolidin-1-ylethenyl]morpholine?
The IUPAC name of 4-[(E)-2-fluoro-1-pyrrolidin-1-ylethenyl]morpholine (CID 135169406) is 4-[(E)-2-fluoro-1-pyrrolidin-1-ylethenyl]morpholine.
What is the SMILES notation for 4-[(E)-2-fluoro-1-pyrrolidin-1-ylethenyl]morpholine?
The canonical SMILES for 4-[(E)-2-fluoro-1-pyrrolidin-1-ylethenyl]morpholine is F/C=C(\N1CCCC1)N1CCOCC1.
What is the InChIKey of 4-[(E)-2-fluoro-1-pyrrolidin-1-ylethenyl]morpholine?
The InChIKey is XYRNUPHBOCTULZ-MDZDMXLPSA-N. The full InChI is InChI=1S/C10H17FN2O/c11-9-10(12-3-1-2-4-12)13-5-7-14-8-6-13/h9H,1-8H2/b10-9+.
What are the key properties of 4-[(E)-2-fluoro-1-pyrrolidin-1-ylethenyl]morpholine?
4-[(E)-2-fluoro-1-pyrrolidin-1-ylethenyl]morpholine has a molecular weight of 200.26 g/mol, XLogP of 1.18, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(E)-2-fluoro-1-pyrrolidin-1-ylethenyl]morpholine is sourced from PubChem (CID 135169406), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).