1-[6-(4-ethyl-2-methoxyphenoxy)-3-pyridinyl]-N-methylmethanamine

C16H20N2O2 — CID 107666919

IUPAC1-[6-(4-ethyl-2-methoxyphenoxy)-3-pyridinyl]-N-methylmethanamine
SMILESCCc1ccc(Oc2ccc(CNC)cn2)c(OC)c1
InChIInChI=1S/C16H20N2O2/c1-4-12-5-7-14(15(9-12)19-3)20-16-8-6-13(10-17-2)11-18-16/h5-9,11,17H,4,10H2,1-3H3
InChIKeyBTJRDIIRDPZVCX-UHFFFAOYSA-N
MW272.35 g/mol
LogP3.16
Rot. Bonds6

About 1-[6-(4-ethyl-2-methoxyphenoxy)-3-pyridinyl]-N-methylmethanamine

1-[6-(4-ethyl-2-methoxyphenoxy)-3-pyridinyl]-N-methylmethanamine (PubChem CID 107666919) has the molecular formula C16H20N2O2 and a molecular weight of 272.35 g/mol. Its IUPAC name is 1-[6-(4-ethyl-2-methoxyphenoxy)-3-pyridinyl]-N-methylmethanamine.

Molecular Properties

Compound Name1-[6-(4-ethyl-2-methoxyphenoxy)-3-pyridinyl]-N-methylmethanamine
PubChem CID107666919
Molecular FormulaC16H20N2O2
Molecular Weight272.35 g/mol
Exact Mass272.15
IUPAC Name1-[6-(4-ethyl-2-methoxyphenoxy)-3-pyridinyl]-N-methylmethanamine
SMILESCCc1ccc(Oc2ccc(CNC)cn2)c(OC)c1
InChIInChI=1S/C16H20N2O2/c1-4-12-5-7-14(15(9-12)19-3)20-16-8-6-13(10-17-2)11-18-16/h5-9,11,17H,4,10H2,1-3H3
InChIKeyBTJRDIIRDPZVCX-UHFFFAOYSA-N
XLogP3.16
TPSA43.38 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 ≤ 53.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-[6-(4-ethyl-2-methoxyphenoxy)-2-methyl-3-pyridinyl]-N-methylmethanamine
CID 107668273
1-[6-(2,6-dimethoxyphenoxy)-3-pyridinyl]-N-methylmethanamine
CID 62298293
1-[6-(2,4-dimethylphenoxy)-3-pyridinyl]-N-methylmethanamine
CID 55058595
1-[6-(2,4-dichlorophenoxy)-3-pyridinyl]-N-methylmethanamine
CID 55058802
1-[6-(4-tert-butyl-2-methylphenoxy)-3-pyridinyl]-N-methylmethanamine
CID 62323119
2-(4-ethyl-2-methoxyphenoxy)-5-methylpyridin-4-amine
CID 107663796
1-[6-(2,3-dimethylphenoxy)-3-pyridinyl]-N-methylmethanamine
CID 62295879
1-[4-chloro-2-(4-ethyl-2-methoxyphenoxy)phenyl]-N-methylmethanamine
CID 107666852
2-[6-[4-(2-amino-2-oxoethyl)-2-methoxyphenoxy]-3-pyridinyl]acetic acid
CID 139479710
1-(4-methoxy-3-propoxyphenyl)-N-methylmethanamine
CID 15079025
[2-[[5-(methylaminomethyl)-2-pyridinyl]oxy]phenyl]methanol
CID 80633758
1-[5-[(4-ethyl-2-methoxyphenoxy)methyl]furan-3-yl]-N-methylmethanamine
CID 107668479

Frequently Asked Questions

What is the IUPAC name of 1-[6-(4-ethyl-2-methoxyphenoxy)-3-pyridinyl]-N-methylmethanamine?
The IUPAC name of 1-[6-(4-ethyl-2-methoxyphenoxy)-3-pyridinyl]-N-methylmethanamine (CID 107666919) is 1-[6-(4-ethyl-2-methoxyphenoxy)-3-pyridinyl]-N-methylmethanamine.
What is the SMILES notation for 1-[6-(4-ethyl-2-methoxyphenoxy)-3-pyridinyl]-N-methylmethanamine?
The canonical SMILES for 1-[6-(4-ethyl-2-methoxyphenoxy)-3-pyridinyl]-N-methylmethanamine is CCc1ccc(Oc2ccc(CNC)cn2)c(OC)c1.
What is the InChIKey of 1-[6-(4-ethyl-2-methoxyphenoxy)-3-pyridinyl]-N-methylmethanamine?
The InChIKey is BTJRDIIRDPZVCX-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N2O2/c1-4-12-5-7-14(15(9-12)19-3)20-16-8-6-13(10-17-2)11-18-16/h5-9,11,17H,4,10H2,1-3H3.
What are the key properties of 1-[6-(4-ethyl-2-methoxyphenoxy)-3-pyridinyl]-N-methylmethanamine?
1-[6-(4-ethyl-2-methoxyphenoxy)-3-pyridinyl]-N-methylmethanamine has a molecular weight of 272.35 g/mol, XLogP of 3.16, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[6-(4-ethyl-2-methoxyphenoxy)-3-pyridinyl]-N-methylmethanamine is sourced from PubChem (CID 107666919), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).