2-methoxy-N-[[1-(oxan-4-ylmethyl)cyclobutyl]methyl]ethanamine

C14H27NO2 — CID 65196724

IUPAC2-methoxy-N-[[1-(oxan-4-ylmethyl)cyclobutyl]methyl]ethanamine
SMILESCOCCNCC1(CC2CCOCC2)CCC1
InChIInChI=1S/C14H27NO2/c1-16-10-7-15-12-14(5-2-6-14)11-13-3-8-17-9-4-13/h13,15H,2-12H2,1H3
InChIKeyNHAZUWJZFGPECD-UHFFFAOYSA-N
MW241.37 g/mol
LogP2.21
Rot. Bonds7

About 2-methoxy-N-[[1-(oxan-4-ylmethyl)cyclobutyl]methyl]ethanamine

2-methoxy-N-[[1-(oxan-4-ylmethyl)cyclobutyl]methyl]ethanamine (PubChem CID 65196724) has the molecular formula C14H27NO2 and a molecular weight of 241.37 g/mol. Its IUPAC name is 2-methoxy-N-[[1-(oxan-4-ylmethyl)cyclobutyl]methyl]ethanamine.

Molecular Properties

Compound Name2-methoxy-N-[[1-(oxan-4-ylmethyl)cyclobutyl]methyl]ethanamine
PubChem CID65196724
Molecular FormulaC14H27NO2
Molecular Weight241.37 g/mol
Exact Mass241.20
IUPAC Name2-methoxy-N-[[1-(oxan-4-ylmethyl)cyclobutyl]methyl]ethanamine
SMILESCOCCNCC1(CC2CCOCC2)CCC1
InChIInChI=1S/C14H27NO2/c1-16-10-7-15-12-14(5-2-6-14)11-13-3-8-17-9-4-13/h13,15H,2-12H2,1H3
InChIKeyNHAZUWJZFGPECD-UHFFFAOYSA-N
XLogP2.21
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.37
LogP ≤ 52.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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-[[1-(oxolan-2-ylmethyl)cyclohexyl]methyl]ethanamine
CID 55106983
N-[[1-[(5,5-dimethyloxolan-2-yl)methyl]cyclopentyl]methyl]-2-methoxyethanamine
CID 116523652
2-methoxy-N-[[1-[(5-methyloxolan-2-yl)methyl]cyclohexyl]methyl]ethanamine
CID 103138492
N-[[1-(aminomethyl)cyclobutyl]methyl]-2-methoxyethanamine
CID 115449017
N-[[3-(oxan-4-ylmethyl)oxolan-3-yl]methyl]propan-1-amine
CID 62718347
2-methoxy-N-[[1-(2-methoxyethyl)cyclohexyl]methyl]ethanamine
CID 62723578
2-methoxy-N-[[3-(1-oxaspiro[4.4]nonan-2-ylmethyl)oxolan-3-yl]methyl]ethanamine
CID 102900401
4-[[1-(chloromethyl)cyclobutyl]methyl]oxane
CID 66033311
2-methoxy-N-(oxolan-3-ylmethyl)ethanamine
CID 43190181
N-[(1-butylcyclobutyl)methyl]-2-methoxyethanamine
CID 65196075
N-[[3-(cyclopentylmethyl)-2-cyclopropyloxolan-3-yl]methyl]-2-methoxyethanamine
CID 104510178

Frequently Asked Questions

What is the IUPAC name of 2-methoxy-N-[[1-(oxan-4-ylmethyl)cyclobutyl]methyl]ethanamine?
The IUPAC name of 2-methoxy-N-[[1-(oxan-4-ylmethyl)cyclobutyl]methyl]ethanamine (CID 65196724) is 2-methoxy-N-[[1-(oxan-4-ylmethyl)cyclobutyl]methyl]ethanamine.
What is the SMILES notation for 2-methoxy-N-[[1-(oxan-4-ylmethyl)cyclobutyl]methyl]ethanamine?
The canonical SMILES for 2-methoxy-N-[[1-(oxan-4-ylmethyl)cyclobutyl]methyl]ethanamine is COCCNCC1(CC2CCOCC2)CCC1.
What is the InChIKey of 2-methoxy-N-[[1-(oxan-4-ylmethyl)cyclobutyl]methyl]ethanamine?
The InChIKey is NHAZUWJZFGPECD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H27NO2/c1-16-10-7-15-12-14(5-2-6-14)11-13-3-8-17-9-4-13/h13,15H,2-12H2,1H3.
What are the key properties of 2-methoxy-N-[[1-(oxan-4-ylmethyl)cyclobutyl]methyl]ethanamine?
2-methoxy-N-[[1-(oxan-4-ylmethyl)cyclobutyl]methyl]ethanamine has a molecular weight of 241.37 g/mol, XLogP of 2.21, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-N-[[1-(oxan-4-ylmethyl)cyclobutyl]methyl]ethanamine is sourced from PubChem (CID 65196724), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).