1-[2-[(6-methoxy-2-pyridinyl)methoxy]-5-methylphenyl]propan-2-amine

C17H22N2O2 — CID 63985125

IUPAC1-[2-[(6-methoxy-2-pyridinyl)methoxy]-5-methylphenyl]propan-2-amine
SMILESCOc1cccc(COc2ccc(C)cc2CC(C)N)n1
InChIInChI=1S/C17H22N2O2/c1-12-7-8-16(14(9-12)10-13(2)18)21-11-15-5-4-6-17(19-15)20-3/h4-9,13H,10-11,18H2,1-3H3
InChIKeyVCENKGCZLWUBLG-UHFFFAOYSA-N
MW286.38 g/mol
LogP2.87
Rot. Bonds6

About 1-[2-[(6-methoxy-2-pyridinyl)methoxy]-5-methylphenyl]propan-2-amine

1-[2-[(6-methoxy-2-pyridinyl)methoxy]-5-methylphenyl]propan-2-amine (PubChem CID 63985125) has the molecular formula C17H22N2O2 and a molecular weight of 286.38 g/mol. Its IUPAC name is 1-[2-[(6-methoxy-2-pyridinyl)methoxy]-5-methylphenyl]propan-2-amine.

Molecular Properties

Compound Name1-[2-[(6-methoxy-2-pyridinyl)methoxy]-5-methylphenyl]propan-2-amine
PubChem CID63985125
Molecular FormulaC17H22N2O2
Molecular Weight286.38 g/mol
Exact Mass286.17
IUPAC Name1-[2-[(6-methoxy-2-pyridinyl)methoxy]-5-methylphenyl]propan-2-amine
SMILESCOc1cccc(COc2ccc(C)cc2CC(C)N)n1
InChIInChI=1S/C17H22N2O2/c1-12-7-8-16(14(9-12)10-13(2)18)21-11-15-5-4-6-17(19-15)20-3/h4-9,13H,10-11,18H2,1-3H3
InChIKeyVCENKGCZLWUBLG-UHFFFAOYSA-N
XLogP2.87
TPSA57.37 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.38
LogP ≤ 52.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-[2-[(6-methoxy-2-pyridinyl)methoxy]-5-methylphenyl]ethanamine
CID 63985124
(1R)-1-[2-[(6-methoxy-2-pyridinyl)methoxy]-5-methylphenyl]ethanamine
CID 63992926
2-[(6-methoxy-2-pyridinyl)methoxy]-4-methylaniline
CID 63991349
2-[(2-fluoro-5-methylphenoxy)methyl]-6-methoxypyridine
CID 64854335
1-[2-[(3,5-dimethylphenyl)methoxy]-5-methylphenyl]propan-2-amine
CID 63325862
(1R)-1-[5-bromo-2-[(6-methoxy-2-pyridinyl)methoxy]phenyl]ethanamine
CID 63992927
1-[5-chloro-2-[(6-methoxy-2-pyridinyl)methoxy]phenyl]ethanamine
CID 63992738
1-[2-(methoxymethoxy)-5-methylphenyl]propan-2-amine
CID 65364966
2-[[2-(bromomethyl)-4-methylphenoxy]methyl]-6-methylpyridine
CID 79260684
4-[(6-methoxy-2-pyridinyl)methoxy]-2,5-dimethylaniline
CID 63993109
1-[2-[(2-chlorophenyl)methoxy]-5-methylphenyl]propan-2-amine
CID 63326375
1-[2-[(2-fluorophenyl)methoxy]-5-methylphenyl]propan-2-amine
CID 63326290

Frequently Asked Questions

What is the IUPAC name of 1-[2-[(6-methoxy-2-pyridinyl)methoxy]-5-methylphenyl]propan-2-amine?
The IUPAC name of 1-[2-[(6-methoxy-2-pyridinyl)methoxy]-5-methylphenyl]propan-2-amine (CID 63985125) is 1-[2-[(6-methoxy-2-pyridinyl)methoxy]-5-methylphenyl]propan-2-amine.
What is the SMILES notation for 1-[2-[(6-methoxy-2-pyridinyl)methoxy]-5-methylphenyl]propan-2-amine?
The canonical SMILES for 1-[2-[(6-methoxy-2-pyridinyl)methoxy]-5-methylphenyl]propan-2-amine is COc1cccc(COc2ccc(C)cc2CC(C)N)n1.
What is the InChIKey of 1-[2-[(6-methoxy-2-pyridinyl)methoxy]-5-methylphenyl]propan-2-amine?
The InChIKey is VCENKGCZLWUBLG-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H22N2O2/c1-12-7-8-16(14(9-12)10-13(2)18)21-11-15-5-4-6-17(19-15)20-3/h4-9,13H,10-11,18H2,1-3H3.
What are the key properties of 1-[2-[(6-methoxy-2-pyridinyl)methoxy]-5-methylphenyl]propan-2-amine?
1-[2-[(6-methoxy-2-pyridinyl)methoxy]-5-methylphenyl]propan-2-amine has a molecular weight of 286.38 g/mol, XLogP of 2.87, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-[(6-methoxy-2-pyridinyl)methoxy]-5-methylphenyl]propan-2-amine is sourced from PubChem (CID 63985125), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).