2-methoxy-N-methyl-1-(oxan-4-yl)ethanamine

C9H19NO2 — CID 63936278

IUPAC2-methoxy-N-methyl-1-(oxan-4-yl)ethanamine
SMILESCNC(COC)C1CCOCC1
InChIInChI=1S/C9H19NO2/c1-10-9(7-11-2)8-3-5-12-6-4-8/h8-10H,3-7H2,1-2H3
InChIKeyIYTKQLOCOSWIEL-UHFFFAOYSA-N
MW173.26 g/mol
LogP0.65
Rot. Bonds4

About 2-methoxy-N-methyl-1-(oxan-4-yl)ethanamine

2-methoxy-N-methyl-1-(oxan-4-yl)ethanamine (PubChem CID 63936278) has the molecular formula C9H19NO2 and a molecular weight of 173.26 g/mol. Its IUPAC name is 2-methoxy-N-methyl-1-(oxan-4-yl)ethanamine.

Molecular Properties

Compound Name2-methoxy-N-methyl-1-(oxan-4-yl)ethanamine
PubChem CID63936278
Molecular FormulaC9H19NO2
Molecular Weight173.26 g/mol
Exact Mass173.14
IUPAC Name2-methoxy-N-methyl-1-(oxan-4-yl)ethanamine
SMILESCNC(COC)C1CCOCC1
InChIInChI=1S/C9H19NO2/c1-10-9(7-11-2)8-3-5-12-6-4-8/h8-10H,3-7H2,1-2H3
InChIKeyIYTKQLOCOSWIEL-UHFFFAOYSA-N
XLogP0.65
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500173.26
LogP ≤ 50.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[2-(2-methoxyethoxy)ethoxy]-N-methyl-1-(oxolan-3-yl)ethanamine
CID 104749761
N,N'-dimethyl-1-(oxan-4-yl)ethane-1,2-diamine
CID 116948007
2-cycloheptyl-N-methyl-1-(oxan-4-yl)ethanamine
CID 115855813
2-methoxy-N-methyl-1-(6-oxaspiro[4.5]decan-9-yl)ethanamine
CID 79915502
2-amino-N-(1-cyclopropyl-2-methoxyethyl)-2-(oxan-4-yl)acetamide
CID 120801790
2-methoxy-N-methyl-1-(4-propylcyclohexyl)ethanamine
CID 79575352
3-ethyl-N-methyl-1-(oxan-4-yl)pentan-1-amine
CID 82923429
methyl 3-methoxy-2-(oxan-4-yl)propanoate
CID 117239855
2-[(1-cyclopropyl-2-methoxyethyl)amino]-1-(oxolan-3-yl)ethanol
CID 115890629
1-cyclobutyl-N-methyl-2-(oxan-4-yl)ethanamine
CID 64986800
N'-(2-methoxyethyl)-N'-(1-methoxypropan-2-yl)-N-methyl-1-(oxolan-3-yl)ethane-1,2-diamine
CID 104745513
N-methyl-1-(oxolan-3-yl)-2-(oxolan-3-ylmethoxy)ethanamine
CID 104749257

Frequently Asked Questions

What is the IUPAC name of 2-methoxy-N-methyl-1-(oxan-4-yl)ethanamine?
The IUPAC name of 2-methoxy-N-methyl-1-(oxan-4-yl)ethanamine (CID 63936278) is 2-methoxy-N-methyl-1-(oxan-4-yl)ethanamine.
What is the SMILES notation for 2-methoxy-N-methyl-1-(oxan-4-yl)ethanamine?
The canonical SMILES for 2-methoxy-N-methyl-1-(oxan-4-yl)ethanamine is CNC(COC)C1CCOCC1.
What is the InChIKey of 2-methoxy-N-methyl-1-(oxan-4-yl)ethanamine?
The InChIKey is IYTKQLOCOSWIEL-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19NO2/c1-10-9(7-11-2)8-3-5-12-6-4-8/h8-10H,3-7H2,1-2H3.
What are the key properties of 2-methoxy-N-methyl-1-(oxan-4-yl)ethanamine?
2-methoxy-N-methyl-1-(oxan-4-yl)ethanamine has a molecular weight of 173.26 g/mol, XLogP of 0.65, 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-(oxan-4-yl)ethanamine is sourced from PubChem (CID 63936278), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).