6-(2,6-diazaspiro[3.3]heptan-2-ylmethyl)-3-methyl-1,3-oxazinane

C11H21N3O — CID 129168970

IUPAC6-(2,6-diazaspiro[3.3]heptan-2-ylmethyl)-3-methyl-1,3-oxazinane
SMILESCN1CCC(CN2CC3(CNC3)C2)OC1
InChIInChI=1S/C11H21N3O/c1-13-3-2-10(15-9-13)4-14-7-11(8-14)5-12-6-11/h10,12H,2-9H2,1H3
InChIKeyZYXARWBXQTWORX-UHFFFAOYSA-N
MW211.31 g/mol
LogP-0.43
Rot. Bonds2

About 6-(2,6-diazaspiro[3.3]heptan-2-ylmethyl)-3-methyl-1,3-oxazinane

6-(2,6-diazaspiro[3.3]heptan-2-ylmethyl)-3-methyl-1,3-oxazinane (PubChem CID 129168970) has the molecular formula C11H21N3O and a molecular weight of 211.31 g/mol. Its IUPAC name is 6-(2,6-diazaspiro[3.3]heptan-2-ylmethyl)-3-methyl-1,3-oxazinane.

Molecular Properties

Compound Name6-(2,6-diazaspiro[3.3]heptan-2-ylmethyl)-3-methyl-1,3-oxazinane
PubChem CID129168970
Molecular FormulaC11H21N3O
Molecular Weight211.31 g/mol
Exact Mass211.17
IUPAC Name6-(2,6-diazaspiro[3.3]heptan-2-ylmethyl)-3-methyl-1,3-oxazinane
SMILESCN1CCC(CN2CC3(CNC3)C2)OC1
InChIInChI=1S/C11H21N3O/c1-13-3-2-10(15-9-13)4-14-7-11(8-14)5-12-6-11/h10,12H,2-9H2,1H3
InChIKeyZYXARWBXQTWORX-UHFFFAOYSA-N
XLogP-0.43
TPSA27.74 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.31
LogP ≤ 5-0.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-(2,6-diazaspiro[3.3]heptan-2-ylmethyl)-3-methyl-1,3-oxazinane?
The IUPAC name of 6-(2,6-diazaspiro[3.3]heptan-2-ylmethyl)-3-methyl-1,3-oxazinane (CID 129168970) is 6-(2,6-diazaspiro[3.3]heptan-2-ylmethyl)-3-methyl-1,3-oxazinane.
What is the SMILES notation for 6-(2,6-diazaspiro[3.3]heptan-2-ylmethyl)-3-methyl-1,3-oxazinane?
The canonical SMILES for 6-(2,6-diazaspiro[3.3]heptan-2-ylmethyl)-3-methyl-1,3-oxazinane is CN1CCC(CN2CC3(CNC3)C2)OC1.
What is the InChIKey of 6-(2,6-diazaspiro[3.3]heptan-2-ylmethyl)-3-methyl-1,3-oxazinane?
The InChIKey is ZYXARWBXQTWORX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21N3O/c1-13-3-2-10(15-9-13)4-14-7-11(8-14)5-12-6-11/h10,12H,2-9H2,1H3.
What are the key properties of 6-(2,6-diazaspiro[3.3]heptan-2-ylmethyl)-3-methyl-1,3-oxazinane?
6-(2,6-diazaspiro[3.3]heptan-2-ylmethyl)-3-methyl-1,3-oxazinane has a molecular weight of 211.31 g/mol, XLogP of -0.43, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2,6-diazaspiro[3.3]heptan-2-ylmethyl)-3-methyl-1,3-oxazinane is sourced from PubChem (CID 129168970), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).