4-[3-[(2-phenyl-2,3-dihydroindolizin-6-yl)oxy]propyl]morpholine

C21H26N2O2 — CID 70910960

IUPAC4-[3-[(2-phenyl-2,3-dihydroindolizin-6-yl)oxy]propyl]morpholine
SMILESC1=CC2=CC(c3ccccc3)CN2C=C1OCCCN1CCOCC1
InChIInChI=1S/C21H26N2O2/c1-2-5-18(6-3-1)19-15-20-7-8-21(17-23(20)16-19)25-12-4-9-22-10-13-24-14-11-22/h1-3,5-8,15,17,19H,4,9-14,16H2
InChIKeyYIPAUFKHPNWSJI-UHFFFAOYSA-N
MW338.45 g/mol
LogP3.12
Rot. Bonds6

About 4-[3-[(2-phenyl-2,3-dihydroindolizin-6-yl)oxy]propyl]morpholine

4-[3-[(2-phenyl-2,3-dihydroindolizin-6-yl)oxy]propyl]morpholine (PubChem CID 70910960) has the molecular formula C21H26N2O2 and a molecular weight of 338.45 g/mol. Its IUPAC name is 4-[3-[(2-phenyl-2,3-dihydroindolizin-6-yl)oxy]propyl]morpholine.

Molecular Properties

Compound Name4-[3-[(2-phenyl-2,3-dihydroindolizin-6-yl)oxy]propyl]morpholine
PubChem CID70910960
Molecular FormulaC21H26N2O2
Molecular Weight338.45 g/mol
Exact Mass338.20
IUPAC Name4-[3-[(2-phenyl-2,3-dihydroindolizin-6-yl)oxy]propyl]morpholine
SMILESC1=CC2=CC(c3ccccc3)CN2C=C1OCCCN1CCOCC1
InChIInChI=1S/C21H26N2O2/c1-2-5-18(6-3-1)19-15-20-7-8-21(17-23(20)16-19)25-12-4-9-22-10-13-24-14-11-22/h1-3,5-8,15,17,19H,4,9-14,16H2
InChIKeyYIPAUFKHPNWSJI-UHFFFAOYSA-N
XLogP3.12
TPSA24.94 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500338.45
LogP ≤ 53.12
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

4-[(3Z)-2-ethoxy-6-nitro-5-phenylhexa-1,3-dien-3-yl]morpholine
CID 134886016
4-[3-ethoxy-2-[(E)-3-methyl-1-phenylbut-1-enyl]-5-phenylcyclopenta-2,4-dien-1-yl]morpholine
CID 10573908
4-[3-ethoxy-2-[(E)-1-phenylprop-1-enyl]-5-prop-1-en-2-ylcyclopenta-2,4-dien-1-yl]morpholine
CID 10617934
4-[3-ethoxy-2-[(E)-3-methyl-1-phenylbut-1-enyl]-5-prop-1-en-2-ylcyclopenta-2,4-dien-1-yl]morpholine
CID 10691153
4-[5-(cyclohexen-1-yl)-3-ethoxy-2-[(E)-1-phenylprop-1-enyl]cyclopenta-2,4-dien-1-yl]morpholine
CID 10715505
4-[3-ethoxy-5-phenyl-2-[(E)-1-phenylprop-1-enyl]cyclopenta-2,4-dien-1-yl]morpholine
CID 11794607
3-[9-(3-Morpholin-4-ylpropoxy)-1,2,3,5-tetrahydropyrrolo[2,1-a]isoquinolin-6-yl]benzonitrile
CID 87439145
N,N-dimethyl-2-[(1,2,2-trimethyl-4-phenyl-3,4,4a,5-tetrahydroquinolin-7-yl)oxy]ethanamine
CID 148240382
4-[1-(2-phenylethyl)-2H-pyridin-4-yl]morpholine
CID 152540539
2-[(2,2-dimethyl-4-phenyl-3,4,4a,5-tetrahydro-1H-quinolin-7-yl)oxy]-N,N-dimethylethanamine
CID 152752554
4-[2-[(1E,3S)-3,7-dimethyl-1-phenylocta-1,6-dienyl]-3-ethoxy-5-phenylcyclopenta-2,4-dien-1-yl]morpholine
CID 10576811
4-[2-[(1E,3S)-3,7-dimethyl-1-phenylocta-1,6-dienyl]-3-ethoxy-5-prop-1-en-2-ylcyclopenta-2,4-dien-1-yl]morpholine
CID 10718293

Frequently Asked Questions

What is the IUPAC name of 4-[3-[(2-phenyl-2,3-dihydroindolizin-6-yl)oxy]propyl]morpholine?
The IUPAC name of 4-[3-[(2-phenyl-2,3-dihydroindolizin-6-yl)oxy]propyl]morpholine (CID 70910960) is 4-[3-[(2-phenyl-2,3-dihydroindolizin-6-yl)oxy]propyl]morpholine.
What is the SMILES notation for 4-[3-[(2-phenyl-2,3-dihydroindolizin-6-yl)oxy]propyl]morpholine?
The canonical SMILES for 4-[3-[(2-phenyl-2,3-dihydroindolizin-6-yl)oxy]propyl]morpholine is C1=CC2=CC(c3ccccc3)CN2C=C1OCCCN1CCOCC1.
What is the InChIKey of 4-[3-[(2-phenyl-2,3-dihydroindolizin-6-yl)oxy]propyl]morpholine?
The InChIKey is YIPAUFKHPNWSJI-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H26N2O2/c1-2-5-18(6-3-1)19-15-20-7-8-21(17-23(20)16-19)25-12-4-9-22-10-13-24-14-11-22/h1-3,5-8,15,17,19H,4,9-14,16H2.
What are the key properties of 4-[3-[(2-phenyl-2,3-dihydroindolizin-6-yl)oxy]propyl]morpholine?
4-[3-[(2-phenyl-2,3-dihydroindolizin-6-yl)oxy]propyl]morpholine has a molecular weight of 338.45 g/mol, XLogP of 3.12, 6 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[3-[(2-phenyl-2,3-dihydroindolizin-6-yl)oxy]propyl]morpholine is sourced from PubChem (CID 70910960), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).