4-[[3-(3-piperidin-1-ylpropoxy)-1,2-oxazol-5-yl]methyl]morpholine

C16H27N3O3 — CID 11507838

IUPAC4-[[3-(3-piperidin-1-ylpropoxy)-1,2-oxazol-5-yl]methyl]morpholine
SMILESc1c(OCCCN2CCCCC2)noc1CN1CCOCC1
InChIInChI=1S/C16H27N3O3/c1-2-5-18(6-3-1)7-4-10-21-16-13-15(22-17-16)14-19-8-11-20-12-9-19/h13H,1-12,14H2
InChIKeyADLWZDMYNOGVRT-UHFFFAOYSA-N
MW309.41 g/mol
LogP1.76
Rot. Bonds7

About 4-[[3-(3-piperidin-1-ylpropoxy)-1,2-oxazol-5-yl]methyl]morpholine

4-[[3-(3-piperidin-1-ylpropoxy)-1,2-oxazol-5-yl]methyl]morpholine (PubChem CID 11507838) has the molecular formula C16H27N3O3 and a molecular weight of 309.41 g/mol. Its IUPAC name is 4-[[3-(3-piperidin-1-ylpropoxy)-1,2-oxazol-5-yl]methyl]morpholine.

Molecular Properties

Compound Name4-[[3-(3-piperidin-1-ylpropoxy)-1,2-oxazol-5-yl]methyl]morpholine
PubChem CID11507838
Molecular FormulaC16H27N3O3
Molecular Weight309.41 g/mol
Exact Mass309.21
IUPAC Name4-[[3-(3-piperidin-1-ylpropoxy)-1,2-oxazol-5-yl]methyl]morpholine
SMILESc1c(OCCCN2CCCCC2)noc1CN1CCOCC1
InChIInChI=1S/C16H27N3O3/c1-2-5-18(6-3-1)7-4-10-21-16-13-15(22-17-16)14-19-8-11-20-12-9-19/h13H,1-12,14H2
InChIKeyADLWZDMYNOGVRT-UHFFFAOYSA-N
XLogP1.76
TPSA50.97 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.41
LogP ≤ 51.76
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

Analyze 4-[[3-(3-piperidin-1-ylpropoxy)-1,2-oxazol-5-yl]methyl]morpholine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 4-[[3-(3-piperidin-1-ylpropoxy)-1,2-oxazol-5-yl]methyl]morpholine?
The IUPAC name of 4-[[3-(3-piperidin-1-ylpropoxy)-1,2-oxazol-5-yl]methyl]morpholine (CID 11507838) is 4-[[3-(3-piperidin-1-ylpropoxy)-1,2-oxazol-5-yl]methyl]morpholine.
What is the SMILES notation for 4-[[3-(3-piperidin-1-ylpropoxy)-1,2-oxazol-5-yl]methyl]morpholine?
The canonical SMILES for 4-[[3-(3-piperidin-1-ylpropoxy)-1,2-oxazol-5-yl]methyl]morpholine is c1c(OCCCN2CCCCC2)noc1CN1CCOCC1.
What is the InChIKey of 4-[[3-(3-piperidin-1-ylpropoxy)-1,2-oxazol-5-yl]methyl]morpholine?
The InChIKey is ADLWZDMYNOGVRT-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H27N3O3/c1-2-5-18(6-3-1)7-4-10-21-16-13-15(22-17-16)14-19-8-11-20-12-9-19/h13H,1-12,14H2.
What are the key properties of 4-[[3-(3-piperidin-1-ylpropoxy)-1,2-oxazol-5-yl]methyl]morpholine?
4-[[3-(3-piperidin-1-ylpropoxy)-1,2-oxazol-5-yl]methyl]morpholine has a molecular weight of 309.41 g/mol, XLogP of 1.76, 7 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[[3-(3-piperidin-1-ylpropoxy)-1,2-oxazol-5-yl]methyl]morpholine is sourced from PubChem (CID 11507838), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).