2-[5-[[2-(3-methoxyphenoxy)acetyl]amino]-2-oxo-1-pyridinyl]acetic acid

C16H16N2O6 — CID 169214430

IUPAC2-[5-[[2-(3-methoxyphenoxy)acetyl]amino]-2-oxo-1-pyridinyl]acetic acid
SMILESCOc1cccc(OCC(=O)Nc2ccc(=O)n(CC(=O)O)c2)c1
InChIInChI=1S/C16H16N2O6/c1-23-12-3-2-4-13(7-12)24-10-14(19)17-11-5-6-15(20)18(8-11)9-16(21)22/h2-8H,9-10H2,1H3,(H,17,19)(H,21,22)
InChIKeyXNAZZYPXSXPHOS-UHFFFAOYSA-N
MW332.31 g/mol
LogP0.96
Rot. Bonds7

About 2-[5-[[2-(3-methoxyphenoxy)acetyl]amino]-2-oxo-1-pyridinyl]acetic acid

2-[5-[[2-(3-methoxyphenoxy)acetyl]amino]-2-oxo-1-pyridinyl]acetic acid (PubChem CID 169214430) has the molecular formula C16H16N2O6 and a molecular weight of 332.31 g/mol. Its IUPAC name is 2-[5-[[2-(3-methoxyphenoxy)acetyl]amino]-2-oxo-1-pyridinyl]acetic acid.

Molecular Properties

Compound Name2-[5-[[2-(3-methoxyphenoxy)acetyl]amino]-2-oxo-1-pyridinyl]acetic acid
PubChem CID169214430
Molecular FormulaC16H16N2O6
Molecular Weight332.31 g/mol
Exact Mass332.10
IUPAC Name2-[5-[[2-(3-methoxyphenoxy)acetyl]amino]-2-oxo-1-pyridinyl]acetic acid
SMILESCOc1cccc(OCC(=O)Nc2ccc(=O)n(CC(=O)O)c2)c1
InChIInChI=1S/C16H16N2O6/c1-23-12-3-2-4-13(7-12)24-10-14(19)17-11-5-6-15(20)18(8-11)9-16(21)22/h2-8H,9-10H2,1H3,(H,17,19)(H,21,22)
InChIKeyXNAZZYPXSXPHOS-UHFFFAOYSA-N
XLogP0.96
TPSA106.86 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.31
LogP ≤ 50.96
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

2-[3-[2-(4-methoxyanilino)-2-oxoethoxy]phenoxy]-N-(4-methoxyphenyl)acetamide
CID 71417144
2-(3-methoxyphenoxy)-N-(3-methoxyphenyl)acetamide
CID 19204025
2-(3-ethoxyphenoxy)-N-(3-methoxyphenyl)acetamide
CID 112977809
N-(3-amino-4-ethylphenyl)-2-(3-methoxyphenoxy)acetamide
CID 28867334
N-(3-amino-4-methylphenyl)-2-(3-methoxyphenoxy)acetamide
CID 28867332
2-(3-methoxyphenoxy)-N-(4-sulfamoylphenyl)acetamide
CID 19204089
N-[4-(difluoromethoxy)phenyl]-2-(3-methoxyphenoxy)acetamide
CID 2323436
2-(3,5-dimethoxyphenoxy)-N-(4-phenylphenyl)acetamide
CID 7713896
methyl 2-chloro-5-[[2-(3-methoxyphenoxy)acetyl]amino]benzoate
CID 94600273
N-[3-[[2-(3-methoxyphenoxy)acetyl]amino]phenyl]-2-methylpropanamide
CID 87016346
N-[3-[[2-(4-methoxyphenoxy)acetyl]amino]phenyl]-2-phenoxyacetamide
CID 17231339
propyl 4-[[2-(3-methoxyphenoxy)acetyl]amino]benzoate
CID 19204042

Frequently Asked Questions

What is the IUPAC name of 2-[5-[[2-(3-methoxyphenoxy)acetyl]amino]-2-oxo-1-pyridinyl]acetic acid?
The IUPAC name of 2-[5-[[2-(3-methoxyphenoxy)acetyl]amino]-2-oxo-1-pyridinyl]acetic acid (CID 169214430) is 2-[5-[[2-(3-methoxyphenoxy)acetyl]amino]-2-oxo-1-pyridinyl]acetic acid.
What is the SMILES notation for 2-[5-[[2-(3-methoxyphenoxy)acetyl]amino]-2-oxo-1-pyridinyl]acetic acid?
The canonical SMILES for 2-[5-[[2-(3-methoxyphenoxy)acetyl]amino]-2-oxo-1-pyridinyl]acetic acid is COc1cccc(OCC(=O)Nc2ccc(=O)n(CC(=O)O)c2)c1.
What is the InChIKey of 2-[5-[[2-(3-methoxyphenoxy)acetyl]amino]-2-oxo-1-pyridinyl]acetic acid?
The InChIKey is XNAZZYPXSXPHOS-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16N2O6/c1-23-12-3-2-4-13(7-12)24-10-14(19)17-11-5-6-15(20)18(8-11)9-16(21)22/h2-8H,9-10H2,1H3,(H,17,19)(H,21,22).
What are the key properties of 2-[5-[[2-(3-methoxyphenoxy)acetyl]amino]-2-oxo-1-pyridinyl]acetic acid?
2-[5-[[2-(3-methoxyphenoxy)acetyl]amino]-2-oxo-1-pyridinyl]acetic acid has a molecular weight of 332.31 g/mol, XLogP of 0.96, 7 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[5-[[2-(3-methoxyphenoxy)acetyl]amino]-2-oxo-1-pyridinyl]acetic acid is sourced from PubChem (CID 169214430), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).