(1R)-1-[2-[(6-methoxy-2-pyridinyl)methoxy]-5-methylphenyl]ethanamine

C16H20N2O2 — CID 63992926

IUPAC(1R)-1-[2-[(6-methoxy-2-pyridinyl)methoxy]-5-methylphenyl]ethanamine
SMILESCOc1cccc(COc2ccc(C)cc2[C@@H](C)N)n1
InChIInChI=1S/C16H20N2O2/c1-11-7-8-15(14(9-11)12(2)17)20-10-13-5-4-6-16(18-13)19-3/h4-9,12H,10,17H2,1-3H3/t12-/m1/s1
InChIKeyMFOMXJGSLYOLGL-GFCCVEGCSA-N
MW272.35 g/mol
LogP3.00
Rot. Bonds5

About (1R)-1-[2-[(6-methoxy-2-pyridinyl)methoxy]-5-methylphenyl]ethanamine

(1R)-1-[2-[(6-methoxy-2-pyridinyl)methoxy]-5-methylphenyl]ethanamine (PubChem CID 63992926) has the molecular formula C16H20N2O2 and a molecular weight of 272.35 g/mol. Its IUPAC name is (1R)-1-[2-[(6-methoxy-2-pyridinyl)methoxy]-5-methylphenyl]ethanamine.

Molecular Properties

Compound Name(1R)-1-[2-[(6-methoxy-2-pyridinyl)methoxy]-5-methylphenyl]ethanamine
PubChem CID63992926
Molecular FormulaC16H20N2O2
Molecular Weight272.35 g/mol
Exact Mass272.15
IUPAC Name(1R)-1-[2-[(6-methoxy-2-pyridinyl)methoxy]-5-methylphenyl]ethanamine
SMILESCOc1cccc(COc2ccc(C)cc2[C@@H](C)N)n1
InChIInChI=1S/C16H20N2O2/c1-11-7-8-15(14(9-11)12(2)17)20-10-13-5-4-6-16(18-13)19-3/h4-9,12H,10,17H2,1-3H3/t12-/m1/s1
InChIKeyMFOMXJGSLYOLGL-GFCCVEGCSA-N
XLogP3.00
TPSA57.37 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.35
LogP ≤ 53.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of (1R)-1-[2-[(6-methoxy-2-pyridinyl)methoxy]-5-methylphenyl]ethanamine?
The IUPAC name of (1R)-1-[2-[(6-methoxy-2-pyridinyl)methoxy]-5-methylphenyl]ethanamine (CID 63992926) is (1R)-1-[2-[(6-methoxy-2-pyridinyl)methoxy]-5-methylphenyl]ethanamine.
What is the SMILES notation for (1R)-1-[2-[(6-methoxy-2-pyridinyl)methoxy]-5-methylphenyl]ethanamine?
The canonical SMILES for (1R)-1-[2-[(6-methoxy-2-pyridinyl)methoxy]-5-methylphenyl]ethanamine is COc1cccc(COc2ccc(C)cc2[C@@H](C)N)n1.
What is the InChIKey of (1R)-1-[2-[(6-methoxy-2-pyridinyl)methoxy]-5-methylphenyl]ethanamine?
The InChIKey is MFOMXJGSLYOLGL-GFCCVEGCSA-N. The full InChI is InChI=1S/C16H20N2O2/c1-11-7-8-15(14(9-11)12(2)17)20-10-13-5-4-6-16(18-13)19-3/h4-9,12H,10,17H2,1-3H3/t12-/m1/s1.
What are the key properties of (1R)-1-[2-[(6-methoxy-2-pyridinyl)methoxy]-5-methylphenyl]ethanamine?
(1R)-1-[2-[(6-methoxy-2-pyridinyl)methoxy]-5-methylphenyl]ethanamine has a molecular weight of 272.35 g/mol, XLogP of 3.00, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-1-[2-[(6-methoxy-2-pyridinyl)methoxy]-5-methylphenyl]ethanamine is sourced from PubChem (CID 63992926), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).