5-[[2-(2-methoxyphenyl)acetyl]amino]pyridine-3-carboxylic acid

C15H14N2O4 — CID 63153455

IUPAC5-[[2-(2-methoxyphenyl)acetyl]amino]pyridine-3-carboxylic acid
SMILESCOc1ccccc1CC(=O)Nc1cncc(C(=O)O)c1
InChIInChI=1S/C15H14N2O4/c1-21-13-5-3-2-4-10(13)7-14(18)17-12-6-11(15(19)20)8-16-9-12/h2-6,8-9H,7H2,1H3,(H,17,18)(H,19,20)
InChIKeyOERWCGDAOVRSBA-UHFFFAOYSA-N
MW286.29 g/mol
LogP1.97
Rot. Bonds5

About 5-[[2-(2-methoxyphenyl)acetyl]amino]pyridine-3-carboxylic acid

5-[[2-(2-methoxyphenyl)acetyl]amino]pyridine-3-carboxylic acid (PubChem CID 63153455) has the molecular formula C15H14N2O4 and a molecular weight of 286.29 g/mol. Its IUPAC name is 5-[[2-(2-methoxyphenyl)acetyl]amino]pyridine-3-carboxylic acid.

Molecular Properties

Compound Name5-[[2-(2-methoxyphenyl)acetyl]amino]pyridine-3-carboxylic acid
PubChem CID63153455
Molecular FormulaC15H14N2O4
Molecular Weight286.29 g/mol
Exact Mass286.10
IUPAC Name5-[[2-(2-methoxyphenyl)acetyl]amino]pyridine-3-carboxylic acid
SMILESCOc1ccccc1CC(=O)Nc1cncc(C(=O)O)c1
InChIInChI=1S/C15H14N2O4/c1-21-13-5-3-2-4-10(13)7-14(18)17-12-6-11(15(19)20)8-16-9-12/h2-6,8-9H,7H2,1H3,(H,17,18)(H,19,20)
InChIKeyOERWCGDAOVRSBA-UHFFFAOYSA-N
XLogP1.97
TPSA88.52 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.29
LogP ≤ 51.97
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-[[2-(2-methoxyphenyl)acetyl]amino]pyridine-3-carboxylic acid?
The IUPAC name of 5-[[2-(2-methoxyphenyl)acetyl]amino]pyridine-3-carboxylic acid (CID 63153455) is 5-[[2-(2-methoxyphenyl)acetyl]amino]pyridine-3-carboxylic acid.
What is the SMILES notation for 5-[[2-(2-methoxyphenyl)acetyl]amino]pyridine-3-carboxylic acid?
The canonical SMILES for 5-[[2-(2-methoxyphenyl)acetyl]amino]pyridine-3-carboxylic acid is COc1ccccc1CC(=O)Nc1cncc(C(=O)O)c1.
What is the InChIKey of 5-[[2-(2-methoxyphenyl)acetyl]amino]pyridine-3-carboxylic acid?
The InChIKey is OERWCGDAOVRSBA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14N2O4/c1-21-13-5-3-2-4-10(13)7-14(18)17-12-6-11(15(19)20)8-16-9-12/h2-6,8-9H,7H2,1H3,(H,17,18)(H,19,20).
What are the key properties of 5-[[2-(2-methoxyphenyl)acetyl]amino]pyridine-3-carboxylic acid?
5-[[2-(2-methoxyphenyl)acetyl]amino]pyridine-3-carboxylic acid has a molecular weight of 286.29 g/mol, XLogP of 1.97, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[[2-(2-methoxyphenyl)acetyl]amino]pyridine-3-carboxylic acid is sourced from PubChem (CID 63153455), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).