2,4,4,8,8,9,10,10-octamethyl-1,5-dioxa-9-azaspiro[5.5]undecane

C16H31NO2 — CID 70638396

IUPAC2,4,4,8,8,9,10,10-octamethyl-1,5-dioxa-9-azaspiro[5.5]undecane
SMILESCC1CC(C)(C)OC2(CC(C)(C)N(C)C(C)(C)C2)O1
InChIInChI=1S/C16H31NO2/c1-12-9-15(6,7)19-16(18-12)10-13(2,3)17(8)14(4,5)11-16/h12H,9-11H2,1-8H3
InChIKeyOFUWTAWAOHHZHU-UHFFFAOYSA-N
MW269.43 g/mol
LogP3.57
Rot. Bonds

About 2,4,4,8,8,9,10,10-octamethyl-1,5-dioxa-9-azaspiro[5.5]undecane

2,4,4,8,8,9,10,10-octamethyl-1,5-dioxa-9-azaspiro[5.5]undecane (PubChem CID 70638396) has the molecular formula C16H31NO2 and a molecular weight of 269.43 g/mol. Its IUPAC name is 2,4,4,8,8,9,10,10-octamethyl-1,5-dioxa-9-azaspiro[5.5]undecane.

Molecular Properties

Compound Name2,4,4,8,8,9,10,10-octamethyl-1,5-dioxa-9-azaspiro[5.5]undecane
PubChem CID70638396
Molecular FormulaC16H31NO2
Molecular Weight269.43 g/mol
Exact Mass269.24
IUPAC Name2,4,4,8,8,9,10,10-octamethyl-1,5-dioxa-9-azaspiro[5.5]undecane
SMILESCC1CC(C)(C)OC2(CC(C)(C)N(C)C(C)(C)C2)O1
InChIInChI=1S/C16H31NO2/c1-12-9-15(6,7)19-16(18-12)10-13(2,3)17(8)14(4,5)11-16/h12H,9-11H2,1-8H3
InChIKeyOFUWTAWAOHHZHU-UHFFFAOYSA-N
XLogP3.57
TPSA21.70 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.43
LogP ≤ 53.57
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2,4,4,8,8,9,10,10-octamethyl-1,5-dioxa-9-azaspiro[5.5]undecane?
The IUPAC name of 2,4,4,8,8,9,10,10-octamethyl-1,5-dioxa-9-azaspiro[5.5]undecane (CID 70638396) is 2,4,4,8,8,9,10,10-octamethyl-1,5-dioxa-9-azaspiro[5.5]undecane.
What is the SMILES notation for 2,4,4,8,8,9,10,10-octamethyl-1,5-dioxa-9-azaspiro[5.5]undecane?
The canonical SMILES for 2,4,4,8,8,9,10,10-octamethyl-1,5-dioxa-9-azaspiro[5.5]undecane is CC1CC(C)(C)OC2(CC(C)(C)N(C)C(C)(C)C2)O1.
What is the InChIKey of 2,4,4,8,8,9,10,10-octamethyl-1,5-dioxa-9-azaspiro[5.5]undecane?
The InChIKey is OFUWTAWAOHHZHU-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H31NO2/c1-12-9-15(6,7)19-16(18-12)10-13(2,3)17(8)14(4,5)11-16/h12H,9-11H2,1-8H3.
What are the key properties of 2,4,4,8,8,9,10,10-octamethyl-1,5-dioxa-9-azaspiro[5.5]undecane?
2,4,4,8,8,9,10,10-octamethyl-1,5-dioxa-9-azaspiro[5.5]undecane has a molecular weight of 269.43 g/mol, XLogP of 3.57, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4,4,8,8,9,10,10-octamethyl-1,5-dioxa-9-azaspiro[5.5]undecane is sourced from PubChem (CID 70638396), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).