2-methoxy-1-(1-oxaspiro[5.5]undecan-4-yl)ethanamine

C13H25NO2 — CID 79915039

IUPAC2-methoxy-1-(1-oxaspiro[5.5]undecan-4-yl)ethanamine
SMILESCOCC(N)C1CCOC2(CCCCC2)C1
InChIInChI=1S/C13H25NO2/c1-15-10-12(14)11-5-8-16-13(9-11)6-3-2-4-7-13/h11-12H,2-10,14H2,1H3
InChIKeyAAMWZFVZANBMNN-UHFFFAOYSA-N
MW227.35 g/mol
LogP2.09
Rot. Bonds3

About 2-methoxy-1-(1-oxaspiro[5.5]undecan-4-yl)ethanamine

2-methoxy-1-(1-oxaspiro[5.5]undecan-4-yl)ethanamine (PubChem CID 79915039) has the molecular formula C13H25NO2 and a molecular weight of 227.35 g/mol. Its IUPAC name is 2-methoxy-1-(1-oxaspiro[5.5]undecan-4-yl)ethanamine.

Molecular Properties

Compound Name2-methoxy-1-(1-oxaspiro[5.5]undecan-4-yl)ethanamine
PubChem CID79915039
Molecular FormulaC13H25NO2
Molecular Weight227.35 g/mol
Exact Mass227.19
IUPAC Name2-methoxy-1-(1-oxaspiro[5.5]undecan-4-yl)ethanamine
SMILESCOCC(N)C1CCOC2(CCCCC2)C1
InChIInChI=1S/C13H25NO2/c1-15-10-12(14)11-5-8-16-13(9-11)6-3-2-4-7-13/h11-12H,2-10,14H2,1H3
InChIKeyAAMWZFVZANBMNN-UHFFFAOYSA-N
XLogP2.09
TPSA44.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.35
LogP ≤ 52.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-methoxy-3-methyl-1-(5-oxaspiro[3.5]nonan-8-yl)butan-1-amine
CID 105166209
2-methoxy-1-(6-oxa-2-thiaspiro[4.5]decan-9-yl)ethanamine
CID 79915157
1-(1-oxaspiro[5.5]undecan-4-yl)butan-1-amine
CID 79914693
3-methoxy-1-(6-oxaspiro[4.5]decan-9-yl)butan-1-amine
CID 113391352
2-methoxy-N-methyl-1-(6-oxaspiro[4.5]decan-9-yl)ethanamine
CID 79915502
3-(2,2-difluoroethoxy)-1-(6-oxaspiro[4.5]decan-9-yl)propan-1-amine
CID 103148828
N-ethyl-2-methoxy-1-(6-oxaspiro[4.5]decan-9-yl)ethanamine
CID 79914184
3-methoxy-2-methyl-1-(5-oxaspiro[3.5]nonan-8-yl)propan-1-ol
CID 116502606
N',N'-dimethyl-1-(6-oxaspiro[4.5]decan-9-yl)propane-1,3-diamine
CID 113291213
methyl 2-hydroxy-2-(1-oxaspiro[5.5]undecan-4-yl)acetate
CID 79912845
2-amino-2-(5-oxaspiro[3.5]nonan-8-yl)ethanol
CID 79922665
(1-methoxycyclopentyl)-(6-oxaspiro[4.5]decan-9-yl)methanamine
CID 104610599

Frequently Asked Questions

What is the IUPAC name of 2-methoxy-1-(1-oxaspiro[5.5]undecan-4-yl)ethanamine?
The IUPAC name of 2-methoxy-1-(1-oxaspiro[5.5]undecan-4-yl)ethanamine (CID 79915039) is 2-methoxy-1-(1-oxaspiro[5.5]undecan-4-yl)ethanamine.
What is the SMILES notation for 2-methoxy-1-(1-oxaspiro[5.5]undecan-4-yl)ethanamine?
The canonical SMILES for 2-methoxy-1-(1-oxaspiro[5.5]undecan-4-yl)ethanamine is COCC(N)C1CCOC2(CCCCC2)C1.
What is the InChIKey of 2-methoxy-1-(1-oxaspiro[5.5]undecan-4-yl)ethanamine?
The InChIKey is AAMWZFVZANBMNN-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H25NO2/c1-15-10-12(14)11-5-8-16-13(9-11)6-3-2-4-7-13/h11-12H,2-10,14H2,1H3.
What are the key properties of 2-methoxy-1-(1-oxaspiro[5.5]undecan-4-yl)ethanamine?
2-methoxy-1-(1-oxaspiro[5.5]undecan-4-yl)ethanamine has a molecular weight of 227.35 g/mol, XLogP of 2.09, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-1-(1-oxaspiro[5.5]undecan-4-yl)ethanamine is sourced from PubChem (CID 79915039), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).