2-(2-methoxyethoxy)-N-methyl-N-(2-pyridin-4-ylethyl)acetamide

C13H20N2O3 — CID 113228898

IUPAC2-(2-methoxyethoxy)-N-methyl-N-(2-pyridin-4-ylethyl)acetamide
SMILESCOCCOCC(=O)N(C)CCc1ccncc1
InChIInChI=1S/C13H20N2O3/c1-15(13(16)11-18-10-9-17-2)8-5-12-3-6-14-7-4-12/h3-4,6-7H,5,8-11H2,1-2H3
InChIKeyOXSAEBHVURSSKI-UHFFFAOYSA-N
MW252.31 g/mol
LogP0.75
Rot. Bonds8

About 2-(2-methoxyethoxy)-N-methyl-N-(2-pyridin-4-ylethyl)acetamide

2-(2-methoxyethoxy)-N-methyl-N-(2-pyridin-4-ylethyl)acetamide (PubChem CID 113228898) has the molecular formula C13H20N2O3 and a molecular weight of 252.31 g/mol. Its IUPAC name is 2-(2-methoxyethoxy)-N-methyl-N-(2-pyridin-4-ylethyl)acetamide.

Molecular Properties

Compound Name2-(2-methoxyethoxy)-N-methyl-N-(2-pyridin-4-ylethyl)acetamide
PubChem CID113228898
Molecular FormulaC13H20N2O3
Molecular Weight252.31 g/mol
Exact Mass252.15
IUPAC Name2-(2-methoxyethoxy)-N-methyl-N-(2-pyridin-4-ylethyl)acetamide
SMILESCOCCOCC(=O)N(C)CCc1ccncc1
InChIInChI=1S/C13H20N2O3/c1-15(13(16)11-18-10-9-17-2)8-5-12-3-6-14-7-4-12/h3-4,6-7H,5,8-11H2,1-2H3
InChIKeyOXSAEBHVURSSKI-UHFFFAOYSA-N
XLogP0.75
TPSA51.66 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.31
LogP ≤ 50.75
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

2-chloro-N-methyl-N-(2-pyridin-4-ylethyl)acetamide
CID 60913202
N-methyl-3-[methyl(2-pyridin-4-ylethyl)amino]-N-(2-pyridin-4-ylethyl)propanamide
CID 109025999
N-methyl-2-(methylamino)-N-(2-pyridin-4-ylethyl)acetamide
CID 60913880
2-(2-aminoethoxy)-N-methyl-N-(pyridin-4-ylmethyl)acetamide
CID 79473191
N',2-dimethyl-N'-(2-pyridin-4-ylethyl)butanediamide
CID 112510368
N-methyl-2-[[(2R)-oxan-2-yl]methoxy]-N-(2-pyridin-4-ylethyl)acetamide
CID 99933824
1-(2-methoxyethoxy)-3-[methyl(2-pyridin-4-ylethyl)amino]propan-2-ol
CID 106991778
2-(2-methoxyethoxy)-N-methyl-N-(2-pyridin-4-ylethyl)benzamide
CID 51101796
N-methyl-N-(2-pyridin-4-ylethyl)-2-(3,4,5-trimethoxyphenyl)acetamide
CID 60602562
2-(4-chlorophenyl)-N-methyl-N-(2-pyridin-4-ylethyl)acetamide
CID 110755605
2-(4-aminophenyl)-N-methyl-N-(2-pyridin-4-ylethyl)acetamide
CID 28711694
3-N-(2-methoxyethyl)-5-N-methyl-5-N-(2-pyridin-4-ylethyl)pyridine-3,5-dicarboxamide
CID 109103424

Frequently Asked Questions

What is the IUPAC name of 2-(2-methoxyethoxy)-N-methyl-N-(2-pyridin-4-ylethyl)acetamide?
The IUPAC name of 2-(2-methoxyethoxy)-N-methyl-N-(2-pyridin-4-ylethyl)acetamide (CID 113228898) is 2-(2-methoxyethoxy)-N-methyl-N-(2-pyridin-4-ylethyl)acetamide.
What is the SMILES notation for 2-(2-methoxyethoxy)-N-methyl-N-(2-pyridin-4-ylethyl)acetamide?
The canonical SMILES for 2-(2-methoxyethoxy)-N-methyl-N-(2-pyridin-4-ylethyl)acetamide is COCCOCC(=O)N(C)CCc1ccncc1.
What is the InChIKey of 2-(2-methoxyethoxy)-N-methyl-N-(2-pyridin-4-ylethyl)acetamide?
The InChIKey is OXSAEBHVURSSKI-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2O3/c1-15(13(16)11-18-10-9-17-2)8-5-12-3-6-14-7-4-12/h3-4,6-7H,5,8-11H2,1-2H3.
What are the key properties of 2-(2-methoxyethoxy)-N-methyl-N-(2-pyridin-4-ylethyl)acetamide?
2-(2-methoxyethoxy)-N-methyl-N-(2-pyridin-4-ylethyl)acetamide has a molecular weight of 252.31 g/mol, XLogP of 0.75, 8 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methoxyethoxy)-N-methyl-N-(2-pyridin-4-ylethyl)acetamide is sourced from PubChem (CID 113228898), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).