2-methoxy-N-methyl-1-(6-oxaspiro[4.5]decan-9-yl)ethanamine

C13H25NO2 — CID 79915502

IUPAC2-methoxy-N-methyl-1-(6-oxaspiro[4.5]decan-9-yl)ethanamine
SMILESCNC(COC)C1CCOC2(CCCC2)C1
InChIInChI=1S/C13H25NO2/c1-14-12(10-15-2)11-5-8-16-13(9-11)6-3-4-7-13/h11-12,14H,3-10H2,1-2H3
InChIKeyJCKYWJKIBHQZLS-UHFFFAOYSA-N
MW227.35 g/mol
LogP1.96
Rot. Bonds4

About 2-methoxy-N-methyl-1-(6-oxaspiro[4.5]decan-9-yl)ethanamine

2-methoxy-N-methyl-1-(6-oxaspiro[4.5]decan-9-yl)ethanamine (PubChem CID 79915502) has the molecular formula C13H25NO2 and a molecular weight of 227.35 g/mol. Its IUPAC name is 2-methoxy-N-methyl-1-(6-oxaspiro[4.5]decan-9-yl)ethanamine.

Molecular Properties

Compound Name2-methoxy-N-methyl-1-(6-oxaspiro[4.5]decan-9-yl)ethanamine
PubChem CID79915502
Molecular FormulaC13H25NO2
Molecular Weight227.35 g/mol
Exact Mass227.19
IUPAC Name2-methoxy-N-methyl-1-(6-oxaspiro[4.5]decan-9-yl)ethanamine
SMILESCNC(COC)C1CCOC2(CCCC2)C1
InChIInChI=1S/C13H25NO2/c1-14-12(10-15-2)11-5-8-16-13(9-11)6-3-4-7-13/h11-12,14H,3-10H2,1-2H3
InChIKeyJCKYWJKIBHQZLS-UHFFFAOYSA-N
XLogP1.96
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.35
LogP ≤ 51.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-methoxy-N,3-dimethyl-1-(6-oxaspiro[4.5]decan-9-yl)butan-1-amine
CID 105170251
N-ethyl-2-methoxy-1-(6-oxaspiro[4.5]decan-9-yl)ethanamine
CID 79914184
2-cyclobutyl-N-methyl-1-(6-oxaspiro[4.5]decan-9-yl)ethanamine
CID 103169206
N-methyl-1-(1-oxaspiro[5.5]undecan-4-yl)-3-propoxypropan-1-amine
CID 105169809
2-methoxy-1-(1-oxaspiro[5.5]undecan-4-yl)ethanamine
CID 79915039
3-methoxy-N-methyl-1-(1-oxa-9-thiaspiro[5.5]undecan-4-yl)propan-1-amine
CID 79914460
N-ethyl-3-methoxy-1-(1-oxaspiro[5.5]undecan-4-yl)propan-1-amine
CID 79914734
N-ethyl-4-methoxy-1-(6-oxaspiro[4.5]decan-9-yl)butan-1-amine
CID 79911149
3-methoxy-1-(1-oxaspiro[5.5]undecan-4-yl)-N-propylpropan-1-amine
CID 79915501
2-(3-ethoxycyclobutyl)-N-methyl-1-(6-oxaspiro[4.5]decan-9-yl)ethanamine
CID 103169207
1-cyclohexyl-N-methyl-1-(6-oxaspiro[4.5]decan-9-yl)methanamine
CID 79914062
3-methoxy-2-methyl-1-(5-oxaspiro[3.5]nonan-8-yl)propan-1-ol
CID 116502606

Frequently Asked Questions

What is the IUPAC name of 2-methoxy-N-methyl-1-(6-oxaspiro[4.5]decan-9-yl)ethanamine?
The IUPAC name of 2-methoxy-N-methyl-1-(6-oxaspiro[4.5]decan-9-yl)ethanamine (CID 79915502) is 2-methoxy-N-methyl-1-(6-oxaspiro[4.5]decan-9-yl)ethanamine.
What is the SMILES notation for 2-methoxy-N-methyl-1-(6-oxaspiro[4.5]decan-9-yl)ethanamine?
The canonical SMILES for 2-methoxy-N-methyl-1-(6-oxaspiro[4.5]decan-9-yl)ethanamine is CNC(COC)C1CCOC2(CCCC2)C1.
What is the InChIKey of 2-methoxy-N-methyl-1-(6-oxaspiro[4.5]decan-9-yl)ethanamine?
The InChIKey is JCKYWJKIBHQZLS-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H25NO2/c1-14-12(10-15-2)11-5-8-16-13(9-11)6-3-4-7-13/h11-12,14H,3-10H2,1-2H3.
What are the key properties of 2-methoxy-N-methyl-1-(6-oxaspiro[4.5]decan-9-yl)ethanamine?
2-methoxy-N-methyl-1-(6-oxaspiro[4.5]decan-9-yl)ethanamine has a molecular weight of 227.35 g/mol, XLogP of 1.96, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-N-methyl-1-(6-oxaspiro[4.5]decan-9-yl)ethanamine is sourced from PubChem (CID 79915502), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).