2-[2-[(6-methoxy-2-pyridinyl)methoxy]-3-methylphenyl]ethanamine

C16H20N2O2 — CID 115957600

IUPAC2-[2-[(6-methoxy-2-pyridinyl)methoxy]-3-methylphenyl]ethanamine
SMILESCOc1cccc(COc2c(C)cccc2CCN)n1
InChIInChI=1S/C16H20N2O2/c1-12-5-3-6-13(9-10-17)16(12)20-11-14-7-4-8-15(18-14)19-2/h3-8H,9-11,17H2,1-2H3
InChIKeyWKCGLDHGQZTFCZ-UHFFFAOYSA-N
MW272.35 g/mol
LogP2.48
Rot. Bonds6

About 2-[2-[(6-methoxy-2-pyridinyl)methoxy]-3-methylphenyl]ethanamine

2-[2-[(6-methoxy-2-pyridinyl)methoxy]-3-methylphenyl]ethanamine (PubChem CID 115957600) has the molecular formula C16H20N2O2 and a molecular weight of 272.35 g/mol. Its IUPAC name is 2-[2-[(6-methoxy-2-pyridinyl)methoxy]-3-methylphenyl]ethanamine.

Molecular Properties

Compound Name2-[2-[(6-methoxy-2-pyridinyl)methoxy]-3-methylphenyl]ethanamine
PubChem CID115957600
Molecular FormulaC16H20N2O2
Molecular Weight272.35 g/mol
Exact Mass272.15
IUPAC Name2-[2-[(6-methoxy-2-pyridinyl)methoxy]-3-methylphenyl]ethanamine
SMILESCOc1cccc(COc2c(C)cccc2CCN)n1
InChIInChI=1S/C16H20N2O2/c1-12-5-3-6-13(9-10-17)16(12)20-11-14-7-4-8-15(18-14)19-2/h3-8H,9-11,17H2,1-2H3
InChIKeyWKCGLDHGQZTFCZ-UHFFFAOYSA-N
XLogP2.48
TPSA57.37 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.35
LogP ≤ 52.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-[3-methoxy-2-[(6-methoxy-2-pyridinyl)methoxy]phenyl]ethanamine
CID 63987113
2-[(2,6-dimethylphenoxy)methyl]-6-methoxypyridine
CID 83057705
2-[[2-(bromomethyl)-6-methylphenoxy]methyl]-6-methoxypyridine
CID 112614202
2-[2-[(6-methoxy-2-pyridinyl)methoxy]-5-methylphenyl]ethanamine
CID 63985124
2-[2-(4-methoxybutoxy)-3-methylphenyl]ethanamine
CID 104648854
[3-fluoro-2-[(6-methoxy-2-pyridinyl)methoxy]phenyl]methanol
CID 112613122
2-[(2,3-dimethylphenoxy)methyl]-6-methoxypyridine
CID 103432339
2-[2-[(2-fluorophenyl)methoxy]-3-methylphenyl]ethanamine
CID 112614778
3-[4-[(6-methoxy-2-pyridinyl)methoxy]-2-methylphenyl]prop-2-yn-1-amine
CID 83137702
2-[2-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]-3-methylphenyl]ethanamine
CID 112614814
2-[2-[(4,5-dimethyl-1,2,4-triazol-3-yl)methoxy]-3-methylphenyl]ethanamine
CID 112614892
4-[(6-methoxy-2-pyridinyl)methoxy]-2,5-dimethylaniline
CID 63993109

Frequently Asked Questions

What is the IUPAC name of 2-[2-[(6-methoxy-2-pyridinyl)methoxy]-3-methylphenyl]ethanamine?
The IUPAC name of 2-[2-[(6-methoxy-2-pyridinyl)methoxy]-3-methylphenyl]ethanamine (CID 115957600) is 2-[2-[(6-methoxy-2-pyridinyl)methoxy]-3-methylphenyl]ethanamine.
What is the SMILES notation for 2-[2-[(6-methoxy-2-pyridinyl)methoxy]-3-methylphenyl]ethanamine?
The canonical SMILES for 2-[2-[(6-methoxy-2-pyridinyl)methoxy]-3-methylphenyl]ethanamine is COc1cccc(COc2c(C)cccc2CCN)n1.
What is the InChIKey of 2-[2-[(6-methoxy-2-pyridinyl)methoxy]-3-methylphenyl]ethanamine?
The InChIKey is WKCGLDHGQZTFCZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N2O2/c1-12-5-3-6-13(9-10-17)16(12)20-11-14-7-4-8-15(18-14)19-2/h3-8H,9-11,17H2,1-2H3.
What are the key properties of 2-[2-[(6-methoxy-2-pyridinyl)methoxy]-3-methylphenyl]ethanamine?
2-[2-[(6-methoxy-2-pyridinyl)methoxy]-3-methylphenyl]ethanamine has a molecular weight of 272.35 g/mol, XLogP of 2.48, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-[(6-methoxy-2-pyridinyl)methoxy]-3-methylphenyl]ethanamine is sourced from PubChem (CID 115957600), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).