1-[3-(4-ethoxyphenoxy)-4-pyridinyl]-N-methylmethanamine

C15H18N2O2 — CID 105075216

IUPAC1-[3-(4-ethoxyphenoxy)-4-pyridinyl]-N-methylmethanamine
SMILESCCOc1ccc(Oc2cnccc2CNC)cc1
InChIInChI=1S/C15H18N2O2/c1-3-18-13-4-6-14(7-5-13)19-15-11-17-9-8-12(15)10-16-2/h4-9,11,16H,3,10H2,1-2H3
InChIKeyFTUTWQDXQCIPRU-UHFFFAOYSA-N
MW258.32 g/mol
LogP2.99
Rot. Bonds6

About 1-[3-(4-ethoxyphenoxy)-4-pyridinyl]-N-methylmethanamine

1-[3-(4-ethoxyphenoxy)-4-pyridinyl]-N-methylmethanamine (PubChem CID 105075216) has the molecular formula C15H18N2O2 and a molecular weight of 258.32 g/mol. Its IUPAC name is 1-[3-(4-ethoxyphenoxy)-4-pyridinyl]-N-methylmethanamine.

Molecular Properties

Compound Name1-[3-(4-ethoxyphenoxy)-4-pyridinyl]-N-methylmethanamine
PubChem CID105075216
Molecular FormulaC15H18N2O2
Molecular Weight258.32 g/mol
Exact Mass258.14
IUPAC Name1-[3-(4-ethoxyphenoxy)-4-pyridinyl]-N-methylmethanamine
SMILESCCOc1ccc(Oc2cnccc2CNC)cc1
InChIInChI=1S/C15H18N2O2/c1-3-18-13-4-6-14(7-5-13)19-15-11-17-9-8-12(15)10-16-2/h4-9,11,16H,3,10H2,1-2H3
InChIKeyFTUTWQDXQCIPRU-UHFFFAOYSA-N
XLogP2.99
TPSA43.38 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.32
LogP ≤ 52.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-methyl-1-[3-[4-(trifluoromethoxy)phenoxy]-4-pyridinyl]methanamine
CID 105075970
N-[[3-(4-propoxyphenoxy)-4-pyridinyl]methyl]ethanamine
CID 105075483
N-[[3-(3-ethoxyphenoxy)-4-pyridinyl]methyl]ethanamine
CID 105075595
1-[3-[4-fluoro-3-(trifluoromethyl)phenoxy]-4-pyridinyl]-N-methylmethanamine
CID 102747358
1-[4-(4-chlorophenoxy)-3-pyridinyl]-N-methylmethanamine
CID 81250713
N-methyl-1-(3-prop-2-enoxy-4-pyridinyl)methanamine
CID 105074848
N,N-diethyl-2-[[4-(methylaminomethyl)-3-pyridinyl]oxy]ethanamine
CID 105075378
2-methyl-N-[[3-(4-methylsulfanylphenoxy)-4-pyridinyl]methyl]propan-2-amine
CID 105075661
N-methyl-1-[3-(3-methylbutoxy)-4-pyridinyl]methanamine
CID 105074964
1-[3-(2-tert-butylphenoxy)-4-pyridinyl]-N-methylmethanamine
CID 105075212
1-[4-(4-ethoxyphenoxy)-2-methylphenyl]-N-methylmethanamine
CID 62128798
N-methyl-1-[3-(3-pyridin-4-ylpropoxy)-4-pyridinyl]methanamine
CID 105075104

Frequently Asked Questions

What is the IUPAC name of 1-[3-(4-ethoxyphenoxy)-4-pyridinyl]-N-methylmethanamine?
The IUPAC name of 1-[3-(4-ethoxyphenoxy)-4-pyridinyl]-N-methylmethanamine (CID 105075216) is 1-[3-(4-ethoxyphenoxy)-4-pyridinyl]-N-methylmethanamine.
What is the SMILES notation for 1-[3-(4-ethoxyphenoxy)-4-pyridinyl]-N-methylmethanamine?
The canonical SMILES for 1-[3-(4-ethoxyphenoxy)-4-pyridinyl]-N-methylmethanamine is CCOc1ccc(Oc2cnccc2CNC)cc1.
What is the InChIKey of 1-[3-(4-ethoxyphenoxy)-4-pyridinyl]-N-methylmethanamine?
The InChIKey is FTUTWQDXQCIPRU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2O2/c1-3-18-13-4-6-14(7-5-13)19-15-11-17-9-8-12(15)10-16-2/h4-9,11,16H,3,10H2,1-2H3.
What are the key properties of 1-[3-(4-ethoxyphenoxy)-4-pyridinyl]-N-methylmethanamine?
1-[3-(4-ethoxyphenoxy)-4-pyridinyl]-N-methylmethanamine has a molecular weight of 258.32 g/mol, XLogP of 2.99, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[3-(4-ethoxyphenoxy)-4-pyridinyl]-N-methylmethanamine is sourced from PubChem (CID 105075216), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).