8-[(4-propan-2-ylmorpholin-2-yl)methyl]-1,4-dioxa-8-azaspiro[4.5]decane

C15H28N2O3 — CID 78994145

IUPAC8-[(4-propan-2-ylmorpholin-2-yl)methyl]-1,4-dioxa-8-azaspiro[4.5]decane
SMILESCC(C)N1CCOC(CN2CCC3(CC2)OCCO3)C1
InChIInChI=1S/C15H28N2O3/c1-13(2)17-7-8-18-14(12-17)11-16-5-3-15(4-6-16)19-9-10-20-15/h13-14H,3-12H2,1-2H3
InChIKeyFIZFETZAYJLYSE-UHFFFAOYSA-N
MW284.40 g/mol
LogP0.93
Rot. Bonds3

About 8-[(4-propan-2-ylmorpholin-2-yl)methyl]-1,4-dioxa-8-azaspiro[4.5]decane

8-[(4-propan-2-ylmorpholin-2-yl)methyl]-1,4-dioxa-8-azaspiro[4.5]decane (PubChem CID 78994145) has the molecular formula C15H28N2O3 and a molecular weight of 284.40 g/mol. Its IUPAC name is 8-[(4-propan-2-ylmorpholin-2-yl)methyl]-1,4-dioxa-8-azaspiro[4.5]decane.

Molecular Properties

Compound Name8-[(4-propan-2-ylmorpholin-2-yl)methyl]-1,4-dioxa-8-azaspiro[4.5]decane
PubChem CID78994145
Molecular FormulaC15H28N2O3
Molecular Weight284.40 g/mol
Exact Mass284.21
IUPAC Name8-[(4-propan-2-ylmorpholin-2-yl)methyl]-1,4-dioxa-8-azaspiro[4.5]decane
SMILESCC(C)N1CCOC(CN2CCC3(CC2)OCCO3)C1
InChIInChI=1S/C15H28N2O3/c1-13(2)17-7-8-18-14(12-17)11-16-5-3-15(4-6-16)19-9-10-20-15/h13-14H,3-12H2,1-2H3
InChIKeyFIZFETZAYJLYSE-UHFFFAOYSA-N
XLogP0.93
TPSA34.17 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.40
LogP ≤ 50.93
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 8-[(4-propan-2-ylmorpholin-2-yl)methyl]-1,4-dioxa-8-azaspiro[4.5]decane?
The IUPAC name of 8-[(4-propan-2-ylmorpholin-2-yl)methyl]-1,4-dioxa-8-azaspiro[4.5]decane (CID 78994145) is 8-[(4-propan-2-ylmorpholin-2-yl)methyl]-1,4-dioxa-8-azaspiro[4.5]decane.
What is the SMILES notation for 8-[(4-propan-2-ylmorpholin-2-yl)methyl]-1,4-dioxa-8-azaspiro[4.5]decane?
The canonical SMILES for 8-[(4-propan-2-ylmorpholin-2-yl)methyl]-1,4-dioxa-8-azaspiro[4.5]decane is CC(C)N1CCOC(CN2CCC3(CC2)OCCO3)C1.
What is the InChIKey of 8-[(4-propan-2-ylmorpholin-2-yl)methyl]-1,4-dioxa-8-azaspiro[4.5]decane?
The InChIKey is FIZFETZAYJLYSE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28N2O3/c1-13(2)17-7-8-18-14(12-17)11-16-5-3-15(4-6-16)19-9-10-20-15/h13-14H,3-12H2,1-2H3.
What are the key properties of 8-[(4-propan-2-ylmorpholin-2-yl)methyl]-1,4-dioxa-8-azaspiro[4.5]decane?
8-[(4-propan-2-ylmorpholin-2-yl)methyl]-1,4-dioxa-8-azaspiro[4.5]decane has a molecular weight of 284.40 g/mol, XLogP of 0.93, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 8-[(4-propan-2-ylmorpholin-2-yl)methyl]-1,4-dioxa-8-azaspiro[4.5]decane is sourced from PubChem (CID 78994145), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).