2-methyl-2-azaspiro[3.4]octane;3-methyl-3,9-diazaspiro[5.5]undecane

C18H35N3 — CID 177149163

IUPAC2-methyl-2-azaspiro[3.4]octane;3-methyl-3,9-diazaspiro[5.5]undecane
SMILESCN1CC2(CCCC2)C1.CN1CCC2(CCNCC2)CC1
InChIInChI=1S/C10H20N2.C8H15N/c1-12-8-4-10(5-9-12)2-6-11-7-3-10;1-9-6-8(7-9)4-2-3-5-8/h11H,2-9H2,1H3;2-7H2,1H3
InChIKeyNBIKKZOCGAAOHN-UHFFFAOYSA-N
MW293.50 g/mol
LogP2.57
Rot. Bonds

About 2-methyl-2-azaspiro[3.4]octane;3-methyl-3,9-diazaspiro[5.5]undecane

2-methyl-2-azaspiro[3.4]octane;3-methyl-3,9-diazaspiro[5.5]undecane (PubChem CID 177149163) has the molecular formula C18H35N3 and a molecular weight of 293.50 g/mol. Its IUPAC name is 2-methyl-2-azaspiro[3.4]octane;3-methyl-3,9-diazaspiro[5.5]undecane.

Molecular Properties

Compound Name2-methyl-2-azaspiro[3.4]octane;3-methyl-3,9-diazaspiro[5.5]undecane
PubChem CID177149163
Molecular FormulaC18H35N3
Molecular Weight293.50 g/mol
Exact Mass293.28
IUPAC Name2-methyl-2-azaspiro[3.4]octane;3-methyl-3,9-diazaspiro[5.5]undecane
SMILESCN1CC2(CCCC2)C1.CN1CCC2(CCNCC2)CC1
InChIInChI=1S/C10H20N2.C8H15N/c1-12-8-4-10(5-9-12)2-6-11-7-3-10;1-9-6-8(7-9)4-2-3-5-8/h11H,2-9H2,1H3;2-7H2,1H3
InChIKeyNBIKKZOCGAAOHN-UHFFFAOYSA-N
XLogP2.57
TPSA18.51 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.50
LogP ≤ 52.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-2-azaspiro[3.4]octane;3-methyl-3,9-diazaspiro[5.5]undecane?
The IUPAC name of 2-methyl-2-azaspiro[3.4]octane;3-methyl-3,9-diazaspiro[5.5]undecane (CID 177149163) is 2-methyl-2-azaspiro[3.4]octane;3-methyl-3,9-diazaspiro[5.5]undecane.
What is the SMILES notation for 2-methyl-2-azaspiro[3.4]octane;3-methyl-3,9-diazaspiro[5.5]undecane?
The canonical SMILES for 2-methyl-2-azaspiro[3.4]octane;3-methyl-3,9-diazaspiro[5.5]undecane is CN1CC2(CCCC2)C1.CN1CCC2(CCNCC2)CC1.
What is the InChIKey of 2-methyl-2-azaspiro[3.4]octane;3-methyl-3,9-diazaspiro[5.5]undecane?
The InChIKey is NBIKKZOCGAAOHN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2.C8H15N/c1-12-8-4-10(5-9-12)2-6-11-7-3-10;1-9-6-8(7-9)4-2-3-5-8/h11H,2-9H2,1H3;2-7H2,1H3.
What are the key properties of 2-methyl-2-azaspiro[3.4]octane;3-methyl-3,9-diazaspiro[5.5]undecane?
2-methyl-2-azaspiro[3.4]octane;3-methyl-3,9-diazaspiro[5.5]undecane has a molecular weight of 293.50 g/mol, XLogP of 2.57, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-2-azaspiro[3.4]octane;3-methyl-3,9-diazaspiro[5.5]undecane is sourced from PubChem (CID 177149163), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).