1-(2-methoxyphenyl)-2-[methyl(pyridin-4-ylmethyl)amino]ethanone

C16H18N2O2 — CID 62052794

IUPAC1-(2-methoxyphenyl)-2-[methyl(pyridin-4-ylmethyl)amino]ethanone
SMILESCOc1ccccc1C(=O)CN(C)Cc1ccncc1
InChIInChI=1S/C16H18N2O2/c1-18(11-13-7-9-17-10-8-13)12-15(19)14-5-3-4-6-16(14)20-2/h3-10H,11-12H2,1-2H3
InChIKeyFPUQTISEJGVLOX-UHFFFAOYSA-N
MW270.33 g/mol
LogP2.40
Rot. Bonds6

About 1-(2-methoxyphenyl)-2-[methyl(pyridin-4-ylmethyl)amino]ethanone

1-(2-methoxyphenyl)-2-[methyl(pyridin-4-ylmethyl)amino]ethanone (PubChem CID 62052794) has the molecular formula C16H18N2O2 and a molecular weight of 270.33 g/mol. Its IUPAC name is 1-(2-methoxyphenyl)-2-[methyl(pyridin-4-ylmethyl)amino]ethanone.

Molecular Properties

Compound Name1-(2-methoxyphenyl)-2-[methyl(pyridin-4-ylmethyl)amino]ethanone
PubChem CID62052794
Molecular FormulaC16H18N2O2
Molecular Weight270.33 g/mol
Exact Mass270.14
IUPAC Name1-(2-methoxyphenyl)-2-[methyl(pyridin-4-ylmethyl)amino]ethanone
SMILESCOc1ccccc1C(=O)CN(C)Cc1ccncc1
InChIInChI=1S/C16H18N2O2/c1-18(11-13-7-9-17-10-8-13)12-15(19)14-5-3-4-6-16(14)20-2/h3-10H,11-12H2,1-2H3
InChIKeyFPUQTISEJGVLOX-UHFFFAOYSA-N
XLogP2.40
TPSA42.43 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.33
LogP ≤ 52.40
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

2-[(4-tert-butylphenyl)methyl-methylamino]-1-(2-methoxyphenyl)ethanone
CID 18333896
2-[benzyl(methyl)amino]-1-(5-fluoro-2-methoxyphenyl)ethanone
CID 62051933
1-(2-methoxyphenyl)-2-[methyl(thiophen-2-ylmethyl)amino]ethanone
CID 60650482
2-[2-ethoxyethyl(methyl)amino]-1-(2-methoxyphenyl)ethanone
CID 81058182
1-[2-[2-[methyl(pyridin-4-ylmethyl)amino]ethoxy]phenyl]ethanone
CID 62052597
2-(2-methoxyphenyl)-N-methyl-N-(pyridin-4-ylmethyl)acetamide
CID 110724807
1-(2,5-dimethylthiophen-3-yl)-2-[methyl(pyridin-4-ylmethyl)amino]ethanone
CID 62050646
2-[[2-(2-methoxyphenyl)-2-oxoethyl]-methylamino]-N-propan-2-ylacetamide
CID 60681671
1,3-bis(2-methoxyphenyl)propane-1,3-dione
CID 15664665
N-formyl-N-[2-(2-methoxyphenyl)-2-oxoethyl]formamide
CID 86593207
1-(5-chlorothiophen-2-yl)-2-[methyl(pyridin-4-ylmethyl)amino]ethanone
CID 62051633
2-[1-hydroxypropan-2-yl(methyl)amino]-1-(2-methoxyphenyl)ethanone
CID 104552748

Frequently Asked Questions

What is the IUPAC name of 1-(2-methoxyphenyl)-2-[methyl(pyridin-4-ylmethyl)amino]ethanone?
The IUPAC name of 1-(2-methoxyphenyl)-2-[methyl(pyridin-4-ylmethyl)amino]ethanone (CID 62052794) is 1-(2-methoxyphenyl)-2-[methyl(pyridin-4-ylmethyl)amino]ethanone.
What is the SMILES notation for 1-(2-methoxyphenyl)-2-[methyl(pyridin-4-ylmethyl)amino]ethanone?
The canonical SMILES for 1-(2-methoxyphenyl)-2-[methyl(pyridin-4-ylmethyl)amino]ethanone is COc1ccccc1C(=O)CN(C)Cc1ccncc1.
What is the InChIKey of 1-(2-methoxyphenyl)-2-[methyl(pyridin-4-ylmethyl)amino]ethanone?
The InChIKey is FPUQTISEJGVLOX-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N2O2/c1-18(11-13-7-9-17-10-8-13)12-15(19)14-5-3-4-6-16(14)20-2/h3-10H,11-12H2,1-2H3.
What are the key properties of 1-(2-methoxyphenyl)-2-[methyl(pyridin-4-ylmethyl)amino]ethanone?
1-(2-methoxyphenyl)-2-[methyl(pyridin-4-ylmethyl)amino]ethanone has a molecular weight of 270.33 g/mol, XLogP of 2.40, 6 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methoxyphenyl)-2-[methyl(pyridin-4-ylmethyl)amino]ethanone is sourced from PubChem (CID 62052794), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).