4-[(E)-3-phenyl-1-pyridin-2-ylprop-2-enyl]morpholine

C18H20N2O — CID 15468868

IUPAC4-[(E)-3-phenyl-1-pyridin-2-ylprop-2-enyl]morpholine
SMILESC(=C/C(c1ccccn1)N1CCOCC1)\c1ccccc1
InChIInChI=1S/C18H20N2O/c1-2-6-16(7-3-1)9-10-18(17-8-4-5-11-19-17)20-12-14-21-15-13-20/h1-11,18H,12-15H2/b10-9+
InChIKeyIVVCHWNERSQPDA-MDZDMXLPSA-N
MW280.37 g/mol
LogP3.17
Rot. Bonds4

About 4-[(E)-3-phenyl-1-pyridin-2-ylprop-2-enyl]morpholine

4-[(E)-3-phenyl-1-pyridin-2-ylprop-2-enyl]morpholine (PubChem CID 15468868) has the molecular formula C18H20N2O and a molecular weight of 280.37 g/mol. Its IUPAC name is 4-[(E)-3-phenyl-1-pyridin-2-ylprop-2-enyl]morpholine.

Molecular Properties

Compound Name4-[(E)-3-phenyl-1-pyridin-2-ylprop-2-enyl]morpholine
PubChem CID15468868
Molecular FormulaC18H20N2O
Molecular Weight280.37 g/mol
Exact Mass280.16
IUPAC Name4-[(E)-3-phenyl-1-pyridin-2-ylprop-2-enyl]morpholine
SMILESC(=C/C(c1ccccn1)N1CCOCC1)\c1ccccc1
InChIInChI=1S/C18H20N2O/c1-2-6-16(7-3-1)9-10-18(17-8-4-5-11-19-17)20-12-14-21-15-13-20/h1-11,18H,12-15H2/b10-9+
InChIKeyIVVCHWNERSQPDA-MDZDMXLPSA-N
XLogP3.17
TPSA25.36 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.37
LogP ≤ 53.17
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-[(E)-3-phenyl-1-pyridin-2-ylprop-2-enyl]morpholine?
The IUPAC name of 4-[(E)-3-phenyl-1-pyridin-2-ylprop-2-enyl]morpholine (CID 15468868) is 4-[(E)-3-phenyl-1-pyridin-2-ylprop-2-enyl]morpholine.
What is the SMILES notation for 4-[(E)-3-phenyl-1-pyridin-2-ylprop-2-enyl]morpholine?
The canonical SMILES for 4-[(E)-3-phenyl-1-pyridin-2-ylprop-2-enyl]morpholine is C(=C/C(c1ccccn1)N1CCOCC1)\c1ccccc1.
What is the InChIKey of 4-[(E)-3-phenyl-1-pyridin-2-ylprop-2-enyl]morpholine?
The InChIKey is IVVCHWNERSQPDA-MDZDMXLPSA-N. The full InChI is InChI=1S/C18H20N2O/c1-2-6-16(7-3-1)9-10-18(17-8-4-5-11-19-17)20-12-14-21-15-13-20/h1-11,18H,12-15H2/b10-9+.
What are the key properties of 4-[(E)-3-phenyl-1-pyridin-2-ylprop-2-enyl]morpholine?
4-[(E)-3-phenyl-1-pyridin-2-ylprop-2-enyl]morpholine has a molecular weight of 280.37 g/mol, XLogP of 3.17, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(E)-3-phenyl-1-pyridin-2-ylprop-2-enyl]morpholine is sourced from PubChem (CID 15468868), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).