N-(3-chlorophenyl)-2-[[1-(2-methoxyethyl)-2-methyl-4-oxo-3-pyridinyl]oxy]acetamide

C17H19ClN2O4 — CID 52901828

IUPACN-(3-chlorophenyl)-2-[[1-(2-methoxyethyl)-2-methyl-4-oxo-3-pyridinyl]oxy]acetamide
SMILESCOCCn1ccc(=O)c(OCC(=O)Nc2cccc(Cl)c2)c1C
InChIInChI=1S/C17H19ClN2O4/c1-12-17(15(21)6-7-20(12)8-9-23-2)24-11-16(22)19-14-5-3-4-13(18)10-14/h3-7,10H,8-9,11H2,1-2H3,(H,19,22)
InChIKeyARKLLOURFISBRJ-UHFFFAOYSA-N
MW350.80 g/mol
LogP2.47
Rot. Bonds7

About N-(3-chlorophenyl)-2-[[1-(2-methoxyethyl)-2-methyl-4-oxo-3-pyridinyl]oxy]acetamide

N-(3-chlorophenyl)-2-[[1-(2-methoxyethyl)-2-methyl-4-oxo-3-pyridinyl]oxy]acetamide (PubChem CID 52901828) has the molecular formula C17H19ClN2O4 and a molecular weight of 350.80 g/mol. Its IUPAC name is N-(3-chlorophenyl)-2-[[1-(2-methoxyethyl)-2-methyl-4-oxo-3-pyridinyl]oxy]acetamide.

Molecular Properties

Compound NameN-(3-chlorophenyl)-2-[[1-(2-methoxyethyl)-2-methyl-4-oxo-3-pyridinyl]oxy]acetamide
PubChem CID52901828
Molecular FormulaC17H19ClN2O4
Molecular Weight350.80 g/mol
Exact Mass350.10
IUPAC NameN-(3-chlorophenyl)-2-[[1-(2-methoxyethyl)-2-methyl-4-oxo-3-pyridinyl]oxy]acetamide
SMILESCOCCn1ccc(=O)c(OCC(=O)Nc2cccc(Cl)c2)c1C
InChIInChI=1S/C17H19ClN2O4/c1-12-17(15(21)6-7-20(12)8-9-23-2)24-11-16(22)19-14-5-3-4-13(18)10-14/h3-7,10H,8-9,11H2,1-2H3,(H,19,22)
InChIKeyARKLLOURFISBRJ-UHFFFAOYSA-N
XLogP2.47
TPSA69.56 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500350.80
LogP ≤ 52.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-(3-chlorophenyl)-2-[[1-(2-methoxyethyl)-2-methyl-4-oxo-3-pyridinyl]oxy]acetamide?
The IUPAC name of N-(3-chlorophenyl)-2-[[1-(2-methoxyethyl)-2-methyl-4-oxo-3-pyridinyl]oxy]acetamide (CID 52901828) is N-(3-chlorophenyl)-2-[[1-(2-methoxyethyl)-2-methyl-4-oxo-3-pyridinyl]oxy]acetamide.
What is the SMILES notation for N-(3-chlorophenyl)-2-[[1-(2-methoxyethyl)-2-methyl-4-oxo-3-pyridinyl]oxy]acetamide?
The canonical SMILES for N-(3-chlorophenyl)-2-[[1-(2-methoxyethyl)-2-methyl-4-oxo-3-pyridinyl]oxy]acetamide is COCCn1ccc(=O)c(OCC(=O)Nc2cccc(Cl)c2)c1C.
What is the InChIKey of N-(3-chlorophenyl)-2-[[1-(2-methoxyethyl)-2-methyl-4-oxo-3-pyridinyl]oxy]acetamide?
The InChIKey is ARKLLOURFISBRJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19ClN2O4/c1-12-17(15(21)6-7-20(12)8-9-23-2)24-11-16(22)19-14-5-3-4-13(18)10-14/h3-7,10H,8-9,11H2,1-2H3,(H,19,22).
What are the key properties of N-(3-chlorophenyl)-2-[[1-(2-methoxyethyl)-2-methyl-4-oxo-3-pyridinyl]oxy]acetamide?
N-(3-chlorophenyl)-2-[[1-(2-methoxyethyl)-2-methyl-4-oxo-3-pyridinyl]oxy]acetamide has a molecular weight of 350.80 g/mol, XLogP of 2.47, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-chlorophenyl)-2-[[1-(2-methoxyethyl)-2-methyl-4-oxo-3-pyridinyl]oxy]acetamide is sourced from PubChem (CID 52901828), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).