2-methoxy-N-[[2-(2-pyridin-2-ylethoxy)phenyl]methyl]ethanamine

C17H22N2O2 — CID 63058176

IUPAC2-methoxy-N-[[2-(2-pyridin-2-ylethoxy)phenyl]methyl]ethanamine
SMILESCOCCNCc1ccccc1OCCc1ccccn1
InChIInChI=1S/C17H22N2O2/c1-20-13-11-18-14-15-6-2-3-8-17(15)21-12-9-16-7-4-5-10-19-16/h2-8,10,18H,9,11-14H2,1H3
InChIKeyNLGRBAODMLYAFU-UHFFFAOYSA-N
MW286.38 g/mol
LogP2.44
Rot. Bonds9

About 2-methoxy-N-[[2-(2-pyridin-2-ylethoxy)phenyl]methyl]ethanamine

2-methoxy-N-[[2-(2-pyridin-2-ylethoxy)phenyl]methyl]ethanamine (PubChem CID 63058176) has the molecular formula C17H22N2O2 and a molecular weight of 286.38 g/mol. Its IUPAC name is 2-methoxy-N-[[2-(2-pyridin-2-ylethoxy)phenyl]methyl]ethanamine.

Molecular Properties

Compound Name2-methoxy-N-[[2-(2-pyridin-2-ylethoxy)phenyl]methyl]ethanamine
PubChem CID63058176
Molecular FormulaC17H22N2O2
Molecular Weight286.38 g/mol
Exact Mass286.17
IUPAC Name2-methoxy-N-[[2-(2-pyridin-2-ylethoxy)phenyl]methyl]ethanamine
SMILESCOCCNCc1ccccc1OCCc1ccccn1
InChIInChI=1S/C17H22N2O2/c1-20-13-11-18-14-15-6-2-3-8-17(15)21-12-9-16-7-4-5-10-19-16/h2-8,10,18H,9,11-14H2,1H3
InChIKeyNLGRBAODMLYAFU-UHFFFAOYSA-N
XLogP2.44
TPSA43.38 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.38
LogP ≤ 52.44
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-[[2-(3-methoxypropoxy)phenyl]methyl]ethanamine
CID 55148747
2-methoxy-N-[(2-octoxyphenyl)methyl]ethanamine
CID 63485820
N-methyl-1-[2-[2-(2-pyridin-2-ylethoxy)ethoxy]phenyl]methanamine
CID 62455565
N-[[5-bromo-2-(pyridin-2-ylmethoxy)phenyl]methyl]-2-methoxyethanamine
CID 60712933
2-methoxy-N-[[2-(4-methylpentoxy)phenyl]methyl]ethanamine
CID 83156925
methyl 3-[2-[(2-methoxyethylamino)methyl]phenoxy]propanoate
CID 63949511
N-[[3-chloro-2-(pyridin-2-ylmethoxy)phenyl]methyl]-2-methoxyethanamine
CID 115954879
2-methoxy-N-[[2-(2-methylidenebutoxy)phenyl]methyl]ethanamine
CID 66047570
N-[[2-[(2-fluorophenyl)methoxy]phenyl]methyl]-2-methoxyethanamine
CID 4720382
2-methoxy-N-[[2-[(1-methylimidazol-2-yl)methoxy]phenyl]methyl]ethanamine
CID 63058179
2-methoxy-N-[[2-(2-methoxyphenoxy)phenyl]methyl]ethanamine
CID 63071959
N-[[2-[2-(2-methoxyethoxy)ethoxy]phenyl]methyl]propan-1-amine
CID 62457882

Frequently Asked Questions

What is the IUPAC name of 2-methoxy-N-[[2-(2-pyridin-2-ylethoxy)phenyl]methyl]ethanamine?
The IUPAC name of 2-methoxy-N-[[2-(2-pyridin-2-ylethoxy)phenyl]methyl]ethanamine (CID 63058176) is 2-methoxy-N-[[2-(2-pyridin-2-ylethoxy)phenyl]methyl]ethanamine.
What is the SMILES notation for 2-methoxy-N-[[2-(2-pyridin-2-ylethoxy)phenyl]methyl]ethanamine?
The canonical SMILES for 2-methoxy-N-[[2-(2-pyridin-2-ylethoxy)phenyl]methyl]ethanamine is COCCNCc1ccccc1OCCc1ccccn1.
What is the InChIKey of 2-methoxy-N-[[2-(2-pyridin-2-ylethoxy)phenyl]methyl]ethanamine?
The InChIKey is NLGRBAODMLYAFU-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H22N2O2/c1-20-13-11-18-14-15-6-2-3-8-17(15)21-12-9-16-7-4-5-10-19-16/h2-8,10,18H,9,11-14H2,1H3.
What are the key properties of 2-methoxy-N-[[2-(2-pyridin-2-ylethoxy)phenyl]methyl]ethanamine?
2-methoxy-N-[[2-(2-pyridin-2-ylethoxy)phenyl]methyl]ethanamine has a molecular weight of 286.38 g/mol, XLogP of 2.44, 9 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-N-[[2-(2-pyridin-2-ylethoxy)phenyl]methyl]ethanamine is sourced from PubChem (CID 63058176), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).