3-methyl-1-oxa-3,8-diazaspiro[4.5]decan-2-one

C8H14N2O2 — CID 10329737

IUPAC3-methyl-1-oxa-3,8-diazaspiro[4.5]decan-2-one
SMILESCN1CC2(CCNCC2)OC1=O
InChIInChI=1S/C8H14N2O2/c1-10-6-8(12-7(10)11)2-4-9-5-3-8/h9H,2-6H2,1H3
InChIKeyJDMUQPZSWZFNMW-UHFFFAOYSA-N
MW170.21 g/mol
LogP0.19
Rot. Bonds

About 3-methyl-1-oxa-3,8-diazaspiro[4.5]decan-2-one

3-methyl-1-oxa-3,8-diazaspiro[4.5]decan-2-one (PubChem CID 10329737) has the molecular formula C8H14N2O2 and a molecular weight of 170.21 g/mol. Its IUPAC name is 3-methyl-1-oxa-3,8-diazaspiro[4.5]decan-2-one.

Molecular Properties

Compound Name3-methyl-1-oxa-3,8-diazaspiro[4.5]decan-2-one
PubChem CID10329737
Molecular FormulaC8H14N2O2
Molecular Weight170.21 g/mol
Exact Mass170.11
IUPAC Name3-methyl-1-oxa-3,8-diazaspiro[4.5]decan-2-one
SMILESCN1CC2(CCNCC2)OC1=O
InChIInChI=1S/C8H14N2O2/c1-10-6-8(12-7(10)11)2-4-9-5-3-8/h9H,2-6H2,1H3
InChIKeyJDMUQPZSWZFNMW-UHFFFAOYSA-N
XLogP0.19
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.21
LogP ≤ 50.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-methyl-1-oxa-3,8-diazaspiro[4.5]decan-2-one?
The IUPAC name of 3-methyl-1-oxa-3,8-diazaspiro[4.5]decan-2-one (CID 10329737) is 3-methyl-1-oxa-3,8-diazaspiro[4.5]decan-2-one.
What is the SMILES notation for 3-methyl-1-oxa-3,8-diazaspiro[4.5]decan-2-one?
The canonical SMILES for 3-methyl-1-oxa-3,8-diazaspiro[4.5]decan-2-one is CN1CC2(CCNCC2)OC1=O.
What is the InChIKey of 3-methyl-1-oxa-3,8-diazaspiro[4.5]decan-2-one?
The InChIKey is JDMUQPZSWZFNMW-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14N2O2/c1-10-6-8(12-7(10)11)2-4-9-5-3-8/h9H,2-6H2,1H3.
What are the key properties of 3-methyl-1-oxa-3,8-diazaspiro[4.5]decan-2-one?
3-methyl-1-oxa-3,8-diazaspiro[4.5]decan-2-one has a molecular weight of 170.21 g/mol, XLogP of 0.19, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-1-oxa-3,8-diazaspiro[4.5]decan-2-one is sourced from PubChem (CID 10329737), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).