2,2,3,7,7,8,9,9-octamethyl-1-oxa-3,8-diazaspiro[4.5]decan-4-one

C15H28N2O2 — CID 18716435

IUPAC2,2,3,7,7,8,9,9-octamethyl-1-oxa-3,8-diazaspiro[4.5]decan-4-one
SMILESCN1C(C)(C)CC2(CC1(C)C)OC(C)(C)N(C)C2=O
InChIInChI=1S/C15H28N2O2/c1-12(2)9-15(10-13(3,4)17(12)8)11(18)16(7)14(5,6)19-15/h9-10H2,1-8H3
InChIKeyHIHVSPKCVJGHLO-UHFFFAOYSA-N
MW268.40 g/mol
LogP2.23
Rot. Bonds

About 2,2,3,7,7,8,9,9-octamethyl-1-oxa-3,8-diazaspiro[4.5]decan-4-one

2,2,3,7,7,8,9,9-octamethyl-1-oxa-3,8-diazaspiro[4.5]decan-4-one (PubChem CID 18716435) has the molecular formula C15H28N2O2 and a molecular weight of 268.40 g/mol. Its IUPAC name is 2,2,3,7,7,8,9,9-octamethyl-1-oxa-3,8-diazaspiro[4.5]decan-4-one.

Molecular Properties

Compound Name2,2,3,7,7,8,9,9-octamethyl-1-oxa-3,8-diazaspiro[4.5]decan-4-one
PubChem CID18716435
Molecular FormulaC15H28N2O2
Molecular Weight268.40 g/mol
Exact Mass268.22
IUPAC Name2,2,3,7,7,8,9,9-octamethyl-1-oxa-3,8-diazaspiro[4.5]decan-4-one
SMILESCN1C(C)(C)CC2(CC1(C)C)OC(C)(C)N(C)C2=O
InChIInChI=1S/C15H28N2O2/c1-12(2)9-15(10-13(3,4)17(12)8)11(18)16(7)14(5,6)19-15/h9-10H2,1-8H3
InChIKeyHIHVSPKCVJGHLO-UHFFFAOYSA-N
XLogP2.23
TPSA32.78 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.40
LogP ≤ 52.23
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2,2,3,7,7,8,9,9-octamethyl-1-oxa-3,8-diazaspiro[4.5]decan-4-one?
The IUPAC name of 2,2,3,7,7,8,9,9-octamethyl-1-oxa-3,8-diazaspiro[4.5]decan-4-one (CID 18716435) is 2,2,3,7,7,8,9,9-octamethyl-1-oxa-3,8-diazaspiro[4.5]decan-4-one.
What is the SMILES notation for 2,2,3,7,7,8,9,9-octamethyl-1-oxa-3,8-diazaspiro[4.5]decan-4-one?
The canonical SMILES for 2,2,3,7,7,8,9,9-octamethyl-1-oxa-3,8-diazaspiro[4.5]decan-4-one is CN1C(C)(C)CC2(CC1(C)C)OC(C)(C)N(C)C2=O.
What is the InChIKey of 2,2,3,7,7,8,9,9-octamethyl-1-oxa-3,8-diazaspiro[4.5]decan-4-one?
The InChIKey is HIHVSPKCVJGHLO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28N2O2/c1-12(2)9-15(10-13(3,4)17(12)8)11(18)16(7)14(5,6)19-15/h9-10H2,1-8H3.
What are the key properties of 2,2,3,7,7,8,9,9-octamethyl-1-oxa-3,8-diazaspiro[4.5]decan-4-one?
2,2,3,7,7,8,9,9-octamethyl-1-oxa-3,8-diazaspiro[4.5]decan-4-one has a molecular weight of 268.40 g/mol, XLogP of 2.23, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2,3,7,7,8,9,9-octamethyl-1-oxa-3,8-diazaspiro[4.5]decan-4-one is sourced from PubChem (CID 18716435), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).