N-(2-methoxyethyl)-2-[(2-methyl-4-oxo-1H-pyridin-3-yl)oxy]acetamide

C11H16N2O4 — CID 82064563

IUPACN-(2-methoxyethyl)-2-[(2-methyl-4-oxo-1H-pyridin-3-yl)oxy]acetamide
SMILESCOCCNC(=O)COc1c(C)[nH]ccc1=O
InChIInChI=1S/C11H16N2O4/c1-8-11(9(14)3-4-12-8)17-7-10(15)13-5-6-16-2/h3-4H,5-7H2,1-2H3,(H,12,14)(H,13,15)
InChIKeyNKYTUEZVOHPOHH-UHFFFAOYSA-N
MW240.26 g/mol
LogP-0.18
Rot. Bonds6

About N-(2-methoxyethyl)-2-[(2-methyl-4-oxo-1H-pyridin-3-yl)oxy]acetamide

N-(2-methoxyethyl)-2-[(2-methyl-4-oxo-1H-pyridin-3-yl)oxy]acetamide (PubChem CID 82064563) has the molecular formula C11H16N2O4 and a molecular weight of 240.26 g/mol. Its IUPAC name is N-(2-methoxyethyl)-2-[(2-methyl-4-oxo-1H-pyridin-3-yl)oxy]acetamide.

Molecular Properties

Compound NameN-(2-methoxyethyl)-2-[(2-methyl-4-oxo-1H-pyridin-3-yl)oxy]acetamide
PubChem CID82064563
Molecular FormulaC11H16N2O4
Molecular Weight240.26 g/mol
Exact Mass240.11
IUPAC NameN-(2-methoxyethyl)-2-[(2-methyl-4-oxo-1H-pyridin-3-yl)oxy]acetamide
SMILESCOCCNC(=O)COc1c(C)[nH]ccc1=O
InChIInChI=1S/C11H16N2O4/c1-8-11(9(14)3-4-12-8)17-7-10(15)13-5-6-16-2/h3-4H,5-7H2,1-2H3,(H,12,14)(H,13,15)
InChIKeyNKYTUEZVOHPOHH-UHFFFAOYSA-N
XLogP-0.18
TPSA80.42 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.26
LogP ≤ 5-0.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-(2-methoxyethyl)-2-[(2-methyl-4-oxo-1H-pyridin-3-yl)oxy]acetamide?
The IUPAC name of N-(2-methoxyethyl)-2-[(2-methyl-4-oxo-1H-pyridin-3-yl)oxy]acetamide (CID 82064563) is N-(2-methoxyethyl)-2-[(2-methyl-4-oxo-1H-pyridin-3-yl)oxy]acetamide.
What is the SMILES notation for N-(2-methoxyethyl)-2-[(2-methyl-4-oxo-1H-pyridin-3-yl)oxy]acetamide?
The canonical SMILES for N-(2-methoxyethyl)-2-[(2-methyl-4-oxo-1H-pyridin-3-yl)oxy]acetamide is COCCNC(=O)COc1c(C)[nH]ccc1=O.
What is the InChIKey of N-(2-methoxyethyl)-2-[(2-methyl-4-oxo-1H-pyridin-3-yl)oxy]acetamide?
The InChIKey is NKYTUEZVOHPOHH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2O4/c1-8-11(9(14)3-4-12-8)17-7-10(15)13-5-6-16-2/h3-4H,5-7H2,1-2H3,(H,12,14)(H,13,15).
What are the key properties of N-(2-methoxyethyl)-2-[(2-methyl-4-oxo-1H-pyridin-3-yl)oxy]acetamide?
N-(2-methoxyethyl)-2-[(2-methyl-4-oxo-1H-pyridin-3-yl)oxy]acetamide has a molecular weight of 240.26 g/mol, XLogP of -0.18, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxyethyl)-2-[(2-methyl-4-oxo-1H-pyridin-3-yl)oxy]acetamide is sourced from PubChem (CID 82064563), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).