4-[1-[2-(1,4-dioxan-2-yl)ethyl]piperidin-4-yl]morpholine

C15H28N2O3 — CID 139599433

IUPAC4-[1-[2-(1,4-dioxan-2-yl)ethyl]piperidin-4-yl]morpholine
SMILESC1CN(C2CCN(CCC3COCCO3)CC2)CCO1
InChIInChI=1S/C15H28N2O3/c1-4-16(6-3-15-13-19-11-12-20-15)5-2-14(1)17-7-9-18-10-8-17/h14-15H,1-13H2
InChIKeyUUYXRASLXZVMJY-UHFFFAOYSA-N
MW284.40 g/mol
LogP0.59
Rot. Bonds4

About 4-[1-[2-(1,4-dioxan-2-yl)ethyl]piperidin-4-yl]morpholine

4-[1-[2-(1,4-dioxan-2-yl)ethyl]piperidin-4-yl]morpholine (PubChem CID 139599433) has the molecular formula C15H28N2O3 and a molecular weight of 284.40 g/mol. Its IUPAC name is 4-[1-[2-(1,4-dioxan-2-yl)ethyl]piperidin-4-yl]morpholine.

Molecular Properties

Compound Name4-[1-[2-(1,4-dioxan-2-yl)ethyl]piperidin-4-yl]morpholine
PubChem CID139599433
Molecular FormulaC15H28N2O3
Molecular Weight284.40 g/mol
Exact Mass284.21
IUPAC Name4-[1-[2-(1,4-dioxan-2-yl)ethyl]piperidin-4-yl]morpholine
SMILESC1CN(C2CCN(CCC3COCCO3)CC2)CCO1
InChIInChI=1S/C15H28N2O3/c1-4-16(6-3-15-13-19-11-12-20-15)5-2-14(1)17-7-9-18-10-8-17/h14-15H,1-13H2
InChIKeyUUYXRASLXZVMJY-UHFFFAOYSA-N
XLogP0.59
TPSA34.17 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.40
LogP ≤ 50.59
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 4-[1-[2-(1,4-dioxan-2-yl)ethyl]piperidin-4-yl]morpholine?
The IUPAC name of 4-[1-[2-(1,4-dioxan-2-yl)ethyl]piperidin-4-yl]morpholine (CID 139599433) is 4-[1-[2-(1,4-dioxan-2-yl)ethyl]piperidin-4-yl]morpholine.
What is the SMILES notation for 4-[1-[2-(1,4-dioxan-2-yl)ethyl]piperidin-4-yl]morpholine?
The canonical SMILES for 4-[1-[2-(1,4-dioxan-2-yl)ethyl]piperidin-4-yl]morpholine is C1CN(C2CCN(CCC3COCCO3)CC2)CCO1.
What is the InChIKey of 4-[1-[2-(1,4-dioxan-2-yl)ethyl]piperidin-4-yl]morpholine?
The InChIKey is UUYXRASLXZVMJY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28N2O3/c1-4-16(6-3-15-13-19-11-12-20-15)5-2-14(1)17-7-9-18-10-8-17/h14-15H,1-13H2.
What are the key properties of 4-[1-[2-(1,4-dioxan-2-yl)ethyl]piperidin-4-yl]morpholine?
4-[1-[2-(1,4-dioxan-2-yl)ethyl]piperidin-4-yl]morpholine has a molecular weight of 284.40 g/mol, XLogP of 0.59, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[1-[2-(1,4-dioxan-2-yl)ethyl]piperidin-4-yl]morpholine is sourced from PubChem (CID 139599433), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).