2,7-diazaspiro[3.5]nonane;ethane;6-methyl-2,6-diazaspiro[3.4]octane

C16H34N4 — CID 156729203

IUPAC2,7-diazaspiro[3.5]nonane;ethane;6-methyl-2,6-diazaspiro[3.4]octane
SMILESC1CC2(CCN1)CNC2.CC.CN1CCC2(CNC2)C1
InChIInChI=1S/2C7H14N2.C2H6/c1-9-3-2-7(6-9)4-8-5-7;1-3-8-4-2-7(1)5-9-6-7;1-2/h8H,2-6H2,1H3;8-9H,1-6H2;1-2H3
InChIKeyWMGLDEOLJNXSGL-UHFFFAOYSA-N
MW282.48 g/mol
LogP0.90
Rot. Bonds

About 2,7-diazaspiro[3.5]nonane;ethane;6-methyl-2,6-diazaspiro[3.4]octane

2,7-diazaspiro[3.5]nonane;ethane;6-methyl-2,6-diazaspiro[3.4]octane (PubChem CID 156729203) has the molecular formula C16H34N4 and a molecular weight of 282.48 g/mol. Its IUPAC name is 2,7-diazaspiro[3.5]nonane;ethane;6-methyl-2,6-diazaspiro[3.4]octane.

Molecular Properties

Compound Name2,7-diazaspiro[3.5]nonane;ethane;6-methyl-2,6-diazaspiro[3.4]octane
PubChem CID156729203
Molecular FormulaC16H34N4
Molecular Weight282.48 g/mol
Exact Mass282.28
IUPAC Name2,7-diazaspiro[3.5]nonane;ethane;6-methyl-2,6-diazaspiro[3.4]octane
SMILESC1CC2(CCN1)CNC2.CC.CN1CCC2(CNC2)C1
InChIInChI=1S/2C7H14N2.C2H6/c1-9-3-2-7(6-9)4-8-5-7;1-3-8-4-2-7(1)5-9-6-7;1-2/h8H,2-6H2,1H3;8-9H,1-6H2;1-2H3
InChIKeyWMGLDEOLJNXSGL-UHFFFAOYSA-N
XLogP0.90
TPSA39.33 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.48
LogP ≤ 50.90
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2,7-diazaspiro[3.5]nonane;ethane;6-methyl-2,6-diazaspiro[3.4]octane?
The IUPAC name of 2,7-diazaspiro[3.5]nonane;ethane;6-methyl-2,6-diazaspiro[3.4]octane (CID 156729203) is 2,7-diazaspiro[3.5]nonane;ethane;6-methyl-2,6-diazaspiro[3.4]octane.
What is the SMILES notation for 2,7-diazaspiro[3.5]nonane;ethane;6-methyl-2,6-diazaspiro[3.4]octane?
The canonical SMILES for 2,7-diazaspiro[3.5]nonane;ethane;6-methyl-2,6-diazaspiro[3.4]octane is C1CC2(CCN1)CNC2.CC.CN1CCC2(CNC2)C1.
What is the InChIKey of 2,7-diazaspiro[3.5]nonane;ethane;6-methyl-2,6-diazaspiro[3.4]octane?
The InChIKey is WMGLDEOLJNXSGL-UHFFFAOYSA-N. The full InChI is InChI=1S/2C7H14N2.C2H6/c1-9-3-2-7(6-9)4-8-5-7;1-3-8-4-2-7(1)5-9-6-7;1-2/h8H,2-6H2,1H3;8-9H,1-6H2;1-2H3.
What are the key properties of 2,7-diazaspiro[3.5]nonane;ethane;6-methyl-2,6-diazaspiro[3.4]octane?
2,7-diazaspiro[3.5]nonane;ethane;6-methyl-2,6-diazaspiro[3.4]octane has a molecular weight of 282.48 g/mol, XLogP of 0.90, 0 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,7-diazaspiro[3.5]nonane;ethane;6-methyl-2,6-diazaspiro[3.4]octane is sourced from PubChem (CID 156729203), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).