4-[3-[(8-phenyl-5,6,7,8-tetrahydro-2,6-naphthyridin-3-yl)oxy]propyl]morpholine

C21H27N3O2 — CID 15982171

IUPAC4-[3-[(8-phenyl-5,6,7,8-tetrahydro-2,6-naphthyridin-3-yl)oxy]propyl]morpholine
SMILESc1ccc(C2CNCc3cc(OCCCN4CCOCC4)ncc32)cc1
InChIInChI=1S/C21H27N3O2/c1-2-5-17(6-3-1)19-15-22-14-18-13-21(23-16-20(18)19)26-10-4-7-24-8-11-25-12-9-24/h1-3,5-6,13,16,19,22H,4,7-12,14-15H2
InChIKeyXEZZJFIWRQIMPS-UHFFFAOYSA-N
MW353.47 g/mol
LogP2.42
Rot. Bonds6

About 4-[3-[(8-phenyl-5,6,7,8-tetrahydro-2,6-naphthyridin-3-yl)oxy]propyl]morpholine

4-[3-[(8-phenyl-5,6,7,8-tetrahydro-2,6-naphthyridin-3-yl)oxy]propyl]morpholine (PubChem CID 15982171) has the molecular formula C21H27N3O2 and a molecular weight of 353.47 g/mol. Its IUPAC name is 4-[3-[(8-phenyl-5,6,7,8-tetrahydro-2,6-naphthyridin-3-yl)oxy]propyl]morpholine.

Molecular Properties

Compound Name4-[3-[(8-phenyl-5,6,7,8-tetrahydro-2,6-naphthyridin-3-yl)oxy]propyl]morpholine
PubChem CID15982171
Molecular FormulaC21H27N3O2
Molecular Weight353.47 g/mol
Exact Mass353.21
IUPAC Name4-[3-[(8-phenyl-5,6,7,8-tetrahydro-2,6-naphthyridin-3-yl)oxy]propyl]morpholine
SMILESc1ccc(C2CNCc3cc(OCCCN4CCOCC4)ncc32)cc1
InChIInChI=1S/C21H27N3O2/c1-2-5-17(6-3-1)19-15-22-14-18-13-21(23-16-20(18)19)26-10-4-7-24-8-11-25-12-9-24/h1-3,5-6,13,16,19,22H,4,7-12,14-15H2
InChIKeyXEZZJFIWRQIMPS-UHFFFAOYSA-N
XLogP2.42
TPSA46.62 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500353.47
LogP ≤ 52.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

Analyze 4-[3-[(8-phenyl-5,6,7,8-tetrahydro-2,6-naphthyridin-3-yl)oxy]propyl]morpholine with MolForge

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Related Compounds

Sarizotan
CID 6918388
Azd0328
CID 9794392
3-[(2S)-2-amino-3,3-diphenylpropoxy]-5-[(E)-2-(pyridin-4-yl)ethenyl]pyridine
CID 10287639
2-Phenoxy-3-(piperidin-4-yl)pyridine
CID 44133490
2-(2-Fluorophenoxy)-3-(piperidin-4-yl)pyridine
CID 44133851
4-Phenyl-7-(3-(piperidin-1-yl)propoxy)-1,2,3,4-tetrahydro-2,6-naphthyridine
CID 15983456
N,N-diethyl-3-(6-methyl-8-phenyl-5,6,7,8-tetrahydro-2,6-naphthyridin-3-yloxy)propan-1-amine
CID 15983457
4-(2-Chlorophenyl)-7-(3-(piperidin-1-yl)propoxy)-1,2,3,4-tetrahydro-2,6-naphthyridine
CID 15983836
7-(5-Phenoxy-3-pyridinyl)-3-azabicyclo[3.3.1]non-6-ene
CID 57485799
5-(1-Methyl-4-piperidinylidene)-5H-(1)benzopyrano(2,3-b)pyridine
CID 38298
3-[(2S)-2-amino-3-phenylpropoxy]-5-[(E)-2-(pyridin-4-yl)ethenyl]pyridine
CID 20744808
2-[(3-Fluorophenyl)methoxy]-3-methyl-4-(piperidin-4-yl)pyridine
CID 25263327

Frequently Asked Questions

What is the IUPAC name of 4-[3-[(8-phenyl-5,6,7,8-tetrahydro-2,6-naphthyridin-3-yl)oxy]propyl]morpholine?
The IUPAC name of 4-[3-[(8-phenyl-5,6,7,8-tetrahydro-2,6-naphthyridin-3-yl)oxy]propyl]morpholine (CID 15982171) is 4-[3-[(8-phenyl-5,6,7,8-tetrahydro-2,6-naphthyridin-3-yl)oxy]propyl]morpholine.
What is the SMILES notation for 4-[3-[(8-phenyl-5,6,7,8-tetrahydro-2,6-naphthyridin-3-yl)oxy]propyl]morpholine?
The canonical SMILES for 4-[3-[(8-phenyl-5,6,7,8-tetrahydro-2,6-naphthyridin-3-yl)oxy]propyl]morpholine is c1ccc(C2CNCc3cc(OCCCN4CCOCC4)ncc32)cc1.
What is the InChIKey of 4-[3-[(8-phenyl-5,6,7,8-tetrahydro-2,6-naphthyridin-3-yl)oxy]propyl]morpholine?
The InChIKey is XEZZJFIWRQIMPS-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H27N3O2/c1-2-5-17(6-3-1)19-15-22-14-18-13-21(23-16-20(18)19)26-10-4-7-24-8-11-25-12-9-24/h1-3,5-6,13,16,19,22H,4,7-12,14-15H2.
What are the key properties of 4-[3-[(8-phenyl-5,6,7,8-tetrahydro-2,6-naphthyridin-3-yl)oxy]propyl]morpholine?
4-[3-[(8-phenyl-5,6,7,8-tetrahydro-2,6-naphthyridin-3-yl)oxy]propyl]morpholine has a molecular weight of 353.47 g/mol, XLogP of 2.42, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[3-[(8-phenyl-5,6,7,8-tetrahydro-2,6-naphthyridin-3-yl)oxy]propyl]morpholine is sourced from PubChem (CID 15982171), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).