4-[(1,2-diphenylindolizin-3-yl)methyl]morpholine

C25H24N2O — CID 1192790

IUPAC4-[(1,2-diphenylindolizin-3-yl)methyl]morpholine
SMILESc1ccc(-c2c(-c3ccccc3)c3ccccn3c2CN2CCOCC2)cc1
InChIInChI=1S/C25H24N2O/c1-3-9-20(10-4-1)24-22-13-7-8-14-27(22)23(19-26-15-17-28-18-16-26)25(24)21-11-5-2-6-12-21/h1-14H,15-19H2
InChIKeyMSUWHERZLRIMST-UHFFFAOYSA-N
MW368.48 g/mol
LogP5.11
Rot. Bonds4

About 4-[(1,2-diphenylindolizin-3-yl)methyl]morpholine

4-[(1,2-diphenylindolizin-3-yl)methyl]morpholine (PubChem CID 1192790) has the molecular formula C25H24N2O and a molecular weight of 368.48 g/mol. Its IUPAC name is 4-[(1,2-diphenylindolizin-3-yl)methyl]morpholine.

Molecular Properties

Compound Name4-[(1,2-diphenylindolizin-3-yl)methyl]morpholine
PubChem CID1192790
Molecular FormulaC25H24N2O
Molecular Weight368.48 g/mol
Exact Mass368.19
IUPAC Name4-[(1,2-diphenylindolizin-3-yl)methyl]morpholine
SMILESc1ccc(-c2c(-c3ccccc3)c3ccccn3c2CN2CCOCC2)cc1
InChIInChI=1S/C25H24N2O/c1-3-9-20(10-4-1)24-22-13-7-8-14-27(22)23(19-26-15-17-28-18-16-26)25(24)21-11-5-2-6-12-21/h1-14H,15-19H2
InChIKeyMSUWHERZLRIMST-UHFFFAOYSA-N
XLogP5.11
TPSA16.88 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500368.48
LogP ≤ 55.11
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-[(1,2-diphenylindolizin-3-yl)methyl]morpholine?
The IUPAC name of 4-[(1,2-diphenylindolizin-3-yl)methyl]morpholine (CID 1192790) is 4-[(1,2-diphenylindolizin-3-yl)methyl]morpholine.
What is the SMILES notation for 4-[(1,2-diphenylindolizin-3-yl)methyl]morpholine?
The canonical SMILES for 4-[(1,2-diphenylindolizin-3-yl)methyl]morpholine is c1ccc(-c2c(-c3ccccc3)c3ccccn3c2CN2CCOCC2)cc1.
What is the InChIKey of 4-[(1,2-diphenylindolizin-3-yl)methyl]morpholine?
The InChIKey is MSUWHERZLRIMST-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H24N2O/c1-3-9-20(10-4-1)24-22-13-7-8-14-27(22)23(19-26-15-17-28-18-16-26)25(24)21-11-5-2-6-12-21/h1-14H,15-19H2.
What are the key properties of 4-[(1,2-diphenylindolizin-3-yl)methyl]morpholine?
4-[(1,2-diphenylindolizin-3-yl)methyl]morpholine has a molecular weight of 368.48 g/mol, XLogP of 5.11, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(1,2-diphenylindolizin-3-yl)methyl]morpholine is sourced from PubChem (CID 1192790), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).