1-[6-(2,6-dimethoxyphenoxy)-3-pyridinyl]-N-methylmethanamine

C15H18N2O3 — CID 62298293

IUPAC1-[6-(2,6-dimethoxyphenoxy)-3-pyridinyl]-N-methylmethanamine
SMILESCNCc1ccc(Oc2c(OC)cccc2OC)nc1
InChIInChI=1S/C15H18N2O3/c1-16-9-11-7-8-14(17-10-11)20-15-12(18-2)5-4-6-13(15)19-3/h4-8,10,16H,9H2,1-3H3
InChIKeyWMKYESUHLXPRLC-UHFFFAOYSA-N
MW274.32 g/mol
LogP2.61
Rot. Bonds6

About 1-[6-(2,6-dimethoxyphenoxy)-3-pyridinyl]-N-methylmethanamine

1-[6-(2,6-dimethoxyphenoxy)-3-pyridinyl]-N-methylmethanamine (PubChem CID 62298293) has the molecular formula C15H18N2O3 and a molecular weight of 274.32 g/mol. Its IUPAC name is 1-[6-(2,6-dimethoxyphenoxy)-3-pyridinyl]-N-methylmethanamine.

Molecular Properties

Compound Name1-[6-(2,6-dimethoxyphenoxy)-3-pyridinyl]-N-methylmethanamine
PubChem CID62298293
Molecular FormulaC15H18N2O3
Molecular Weight274.32 g/mol
Exact Mass274.13
IUPAC Name1-[6-(2,6-dimethoxyphenoxy)-3-pyridinyl]-N-methylmethanamine
SMILESCNCc1ccc(Oc2c(OC)cccc2OC)nc1
InChIInChI=1S/C15H18N2O3/c1-16-9-11-7-8-14(17-10-11)20-15-12(18-2)5-4-6-13(15)19-3/h4-8,10,16H,9H2,1-3H3
InChIKeyWMKYESUHLXPRLC-UHFFFAOYSA-N
XLogP2.61
TPSA52.61 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.32
LogP ≤ 52.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 1-[6-(2,6-dimethoxyphenoxy)-3-pyridinyl]-N-methylmethanamine?
The IUPAC name of 1-[6-(2,6-dimethoxyphenoxy)-3-pyridinyl]-N-methylmethanamine (CID 62298293) is 1-[6-(2,6-dimethoxyphenoxy)-3-pyridinyl]-N-methylmethanamine.
What is the SMILES notation for 1-[6-(2,6-dimethoxyphenoxy)-3-pyridinyl]-N-methylmethanamine?
The canonical SMILES for 1-[6-(2,6-dimethoxyphenoxy)-3-pyridinyl]-N-methylmethanamine is CNCc1ccc(Oc2c(OC)cccc2OC)nc1.
What is the InChIKey of 1-[6-(2,6-dimethoxyphenoxy)-3-pyridinyl]-N-methylmethanamine?
The InChIKey is WMKYESUHLXPRLC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2O3/c1-16-9-11-7-8-14(17-10-11)20-15-12(18-2)5-4-6-13(15)19-3/h4-8,10,16H,9H2,1-3H3.
What are the key properties of 1-[6-(2,6-dimethoxyphenoxy)-3-pyridinyl]-N-methylmethanamine?
1-[6-(2,6-dimethoxyphenoxy)-3-pyridinyl]-N-methylmethanamine has a molecular weight of 274.32 g/mol, XLogP of 2.61, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[6-(2,6-dimethoxyphenoxy)-3-pyridinyl]-N-methylmethanamine is sourced from PubChem (CID 62298293), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).