N-(2-methoxyethyl)-N-methyl-8-azaspiro[4.5]decan-3-amine

C13H26N2O — CID 175929640

IUPACN-(2-methoxyethyl)-N-methyl-8-azaspiro[4.5]decan-3-amine
SMILESCOCCN(C)C1CCC2(CCNCC2)C1
InChIInChI=1S/C13H26N2O/c1-15(9-10-16-2)12-3-4-13(11-12)5-7-14-8-6-13/h12,14H,3-11H2,1-2H3
InChIKeyUNBUVUZBRAAQPG-UHFFFAOYSA-N
MW226.36 g/mol
LogP1.49
Rot. Bonds4

About N-(2-methoxyethyl)-N-methyl-8-azaspiro[4.5]decan-3-amine

N-(2-methoxyethyl)-N-methyl-8-azaspiro[4.5]decan-3-amine (PubChem CID 175929640) has the molecular formula C13H26N2O and a molecular weight of 226.36 g/mol. Its IUPAC name is N-(2-methoxyethyl)-N-methyl-8-azaspiro[4.5]decan-3-amine.

Molecular Properties

Compound NameN-(2-methoxyethyl)-N-methyl-8-azaspiro[4.5]decan-3-amine
PubChem CID175929640
Molecular FormulaC13H26N2O
Molecular Weight226.36 g/mol
Exact Mass226.20
IUPAC NameN-(2-methoxyethyl)-N-methyl-8-azaspiro[4.5]decan-3-amine
SMILESCOCCN(C)C1CCC2(CCNCC2)C1
InChIInChI=1S/C13H26N2O/c1-15(9-10-16-2)12-3-4-13(11-12)5-7-14-8-6-13/h12,14H,3-11H2,1-2H3
InChIKeyUNBUVUZBRAAQPG-UHFFFAOYSA-N
XLogP1.49
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.36
LogP ≤ 51.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(2-methoxyethyl)-N-methyl-8-azaspiro[4.5]decan-3-amine?
The IUPAC name of N-(2-methoxyethyl)-N-methyl-8-azaspiro[4.5]decan-3-amine (CID 175929640) is N-(2-methoxyethyl)-N-methyl-8-azaspiro[4.5]decan-3-amine.
What is the SMILES notation for N-(2-methoxyethyl)-N-methyl-8-azaspiro[4.5]decan-3-amine?
The canonical SMILES for N-(2-methoxyethyl)-N-methyl-8-azaspiro[4.5]decan-3-amine is COCCN(C)C1CCC2(CCNCC2)C1.
What is the InChIKey of N-(2-methoxyethyl)-N-methyl-8-azaspiro[4.5]decan-3-amine?
The InChIKey is UNBUVUZBRAAQPG-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N2O/c1-15(9-10-16-2)12-3-4-13(11-12)5-7-14-8-6-13/h12,14H,3-11H2,1-2H3.
What are the key properties of N-(2-methoxyethyl)-N-methyl-8-azaspiro[4.5]decan-3-amine?
N-(2-methoxyethyl)-N-methyl-8-azaspiro[4.5]decan-3-amine has a molecular weight of 226.36 g/mol, XLogP of 1.49, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxyethyl)-N-methyl-8-azaspiro[4.5]decan-3-amine is sourced from PubChem (CID 175929640), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).