1-(2-ethoxyphenyl)-N-[(3-ethyl-2-pyridinyl)methyl]methanamine

C17H22N2O — CID 82733206

IUPAC1-(2-ethoxyphenyl)-N-[(3-ethyl-2-pyridinyl)methyl]methanamine
SMILESCCOc1ccccc1CNCc1ncccc1CC
InChIInChI=1S/C17H22N2O/c1-3-14-9-7-11-19-16(14)13-18-12-15-8-5-6-10-17(15)20-4-2/h5-11,18H,3-4,12-13H2,1-2H3
InChIKeyMYBNDSTUHKGVJY-UHFFFAOYSA-N
MW270.38 g/mol
LogP3.33
Rot. Bonds7

About 1-(2-ethoxyphenyl)-N-[(3-ethyl-2-pyridinyl)methyl]methanamine

1-(2-ethoxyphenyl)-N-[(3-ethyl-2-pyridinyl)methyl]methanamine (PubChem CID 82733206) has the molecular formula C17H22N2O and a molecular weight of 270.38 g/mol. Its IUPAC name is 1-(2-ethoxyphenyl)-N-[(3-ethyl-2-pyridinyl)methyl]methanamine.

Molecular Properties

Compound Name1-(2-ethoxyphenyl)-N-[(3-ethyl-2-pyridinyl)methyl]methanamine
PubChem CID82733206
Molecular FormulaC17H22N2O
Molecular Weight270.38 g/mol
Exact Mass270.17
IUPAC Name1-(2-ethoxyphenyl)-N-[(3-ethyl-2-pyridinyl)methyl]methanamine
SMILESCCOc1ccccc1CNCc1ncccc1CC
InChIInChI=1S/C17H22N2O/c1-3-14-9-7-11-19-16(14)13-18-12-15-8-5-6-10-17(15)20-4-2/h5-11,18H,3-4,12-13H2,1-2H3
InChIKeyMYBNDSTUHKGVJY-UHFFFAOYSA-N
XLogP3.33
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.38
LogP ≤ 53.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(3-ethyl-2-pyridinyl)methyl]-1-(2-propan-2-yloxyphenyl)methanamine
CID 82733879
N-[(3,4-dimethoxy-2-pyridinyl)methyl]-1-(3-ethyl-2-pyridinyl)methanamine
CID 103172673
1-(2-ethoxyphenyl)-N-[(3-ethyl-1-methylpyrazol-4-yl)methyl]methanamine
CID 115885559
methyl 3-[[(3-ethyl-2-pyridinyl)methylamino]methyl]furan-2-carboxylate
CID 82732224
2-[(3-ethyl-2-pyridinyl)methylamino]ethanol
CID 82738095
N-[(2-ethoxyphenyl)methyl]-1-[2-(methoxymethyl)phenyl]methanamine
CID 60744247
1-(3,5-dimethylphenyl)-N-[(3-ethyl-2-pyridinyl)methyl]methanamine
CID 82731760
1-(3-chloro-4-pyridinyl)-N-[(3-ethyl-2-pyridinyl)methyl]methanamine
CID 82737650
1-(2-ethoxyphenyl)-N-[(1-methylimidazol-2-yl)methyl]methanamine
CID 63001857
N-[(3-ethyl-2-pyridinyl)methyl]-1-(2-methoxyphenyl)propan-1-amine
CID 82733459
N-[(3-ethyl-2-pyridinyl)methyl]-1-pyrazin-2-ylmethanamine
CID 82733194
1-(2-bromo-5-methoxyphenyl)-N-[(3-ethyl-2-pyridinyl)methyl]methanamine
CID 82738742

Frequently Asked Questions

What is the IUPAC name of 1-(2-ethoxyphenyl)-N-[(3-ethyl-2-pyridinyl)methyl]methanamine?
The IUPAC name of 1-(2-ethoxyphenyl)-N-[(3-ethyl-2-pyridinyl)methyl]methanamine (CID 82733206) is 1-(2-ethoxyphenyl)-N-[(3-ethyl-2-pyridinyl)methyl]methanamine.
What is the SMILES notation for 1-(2-ethoxyphenyl)-N-[(3-ethyl-2-pyridinyl)methyl]methanamine?
The canonical SMILES for 1-(2-ethoxyphenyl)-N-[(3-ethyl-2-pyridinyl)methyl]methanamine is CCOc1ccccc1CNCc1ncccc1CC.
What is the InChIKey of 1-(2-ethoxyphenyl)-N-[(3-ethyl-2-pyridinyl)methyl]methanamine?
The InChIKey is MYBNDSTUHKGVJY-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H22N2O/c1-3-14-9-7-11-19-16(14)13-18-12-15-8-5-6-10-17(15)20-4-2/h5-11,18H,3-4,12-13H2,1-2H3.
What are the key properties of 1-(2-ethoxyphenyl)-N-[(3-ethyl-2-pyridinyl)methyl]methanamine?
1-(2-ethoxyphenyl)-N-[(3-ethyl-2-pyridinyl)methyl]methanamine has a molecular weight of 270.38 g/mol, XLogP of 3.33, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-ethoxyphenyl)-N-[(3-ethyl-2-pyridinyl)methyl]methanamine is sourced from PubChem (CID 82733206), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).