2-methoxy-N-[[3-(methoxymethyl)oxolan-3-yl]methyl]ethanamine

C10H21NO3 — CID 103984642

IUPAC2-methoxy-N-[[3-(methoxymethyl)oxolan-3-yl]methyl]ethanamine
SMILESCOCCNCC1(COC)CCOC1
InChIInChI=1S/C10H21NO3/c1-12-6-4-11-7-10(8-13-2)3-5-14-9-10/h11H,3-9H2,1-2H3
InChIKeyIOWCUMQNOFACQH-UHFFFAOYSA-N
MW203.28 g/mol
LogP0.28
Rot. Bonds7

About 2-methoxy-N-[[3-(methoxymethyl)oxolan-3-yl]methyl]ethanamine

2-methoxy-N-[[3-(methoxymethyl)oxolan-3-yl]methyl]ethanamine (PubChem CID 103984642) has the molecular formula C10H21NO3 and a molecular weight of 203.28 g/mol. Its IUPAC name is 2-methoxy-N-[[3-(methoxymethyl)oxolan-3-yl]methyl]ethanamine.

Molecular Properties

Compound Name2-methoxy-N-[[3-(methoxymethyl)oxolan-3-yl]methyl]ethanamine
PubChem CID103984642
Molecular FormulaC10H21NO3
Molecular Weight203.28 g/mol
Exact Mass203.15
IUPAC Name2-methoxy-N-[[3-(methoxymethyl)oxolan-3-yl]methyl]ethanamine
SMILESCOCCNCC1(COC)CCOC1
InChIInChI=1S/C10H21NO3/c1-12-6-4-11-7-10(8-13-2)3-5-14-9-10/h11H,3-9H2,1-2H3
InChIKeyIOWCUMQNOFACQH-UHFFFAOYSA-N
XLogP0.28
TPSA39.72 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.28
LogP ≤ 50.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

2-methoxy-N-[[3-(oxan-4-ylmethyl)oxolan-3-yl]methyl]ethanamine
CID 62719768
2-methoxy-N-[[3-[(4-methylphenyl)methyl]oxolan-3-yl]methyl]ethanamine
CID 62718692
2-methoxy-N-[[3-(1-oxaspiro[4.4]nonan-2-ylmethyl)oxolan-3-yl]methyl]ethanamine
CID 102900401
N-[[4-(3,3-dimethylbutyl)oxan-4-yl]methyl]-2-methoxyethanamine
CID 62904892
[3-(methoxymethyl)oxolan-3-yl]methanamine
CID 83904977
[1-[(2-methoxyethylamino)methyl]cyclopropyl]methanol
CID 115454729
2-methoxy-N-[[4-(2-methylsulfonylethyl)oxan-4-yl]methyl]ethanamine
CID 62905763
N-[[3-[(4-fluoro-2-methylphenyl)methyl]oxolan-3-yl]methyl]-2-methoxyethanamine
CID 114348893
N-[[3-[(3-bromo-4-methoxyphenyl)methyl]oxolan-3-yl]methyl]-2-methoxyethanamine
CID 62718375
N-[[4-(2-ethylhexyl)oxan-4-yl]methyl]-2-methoxyethanamine
CID 62906281
N-[[4-tert-butyl-1-(methoxymethyl)cyclohexyl]methyl]-2-methoxyethanamine
CID 103984545
N-[[4-[(2,6-difluorophenyl)methyl]oxan-4-yl]methyl]-2-methoxyethanamine
CID 114933662

Frequently Asked Questions

What is the IUPAC name of 2-methoxy-N-[[3-(methoxymethyl)oxolan-3-yl]methyl]ethanamine?
The IUPAC name of 2-methoxy-N-[[3-(methoxymethyl)oxolan-3-yl]methyl]ethanamine (CID 103984642) is 2-methoxy-N-[[3-(methoxymethyl)oxolan-3-yl]methyl]ethanamine.
What is the SMILES notation for 2-methoxy-N-[[3-(methoxymethyl)oxolan-3-yl]methyl]ethanamine?
The canonical SMILES for 2-methoxy-N-[[3-(methoxymethyl)oxolan-3-yl]methyl]ethanamine is COCCNCC1(COC)CCOC1.
What is the InChIKey of 2-methoxy-N-[[3-(methoxymethyl)oxolan-3-yl]methyl]ethanamine?
The InChIKey is IOWCUMQNOFACQH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21NO3/c1-12-6-4-11-7-10(8-13-2)3-5-14-9-10/h11H,3-9H2,1-2H3.
What are the key properties of 2-methoxy-N-[[3-(methoxymethyl)oxolan-3-yl]methyl]ethanamine?
2-methoxy-N-[[3-(methoxymethyl)oxolan-3-yl]methyl]ethanamine has a molecular weight of 203.28 g/mol, XLogP of 0.28, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-N-[[3-(methoxymethyl)oxolan-3-yl]methyl]ethanamine is sourced from PubChem (CID 103984642), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).