6-[(2-methoxy-2-phenylacetyl)amino]pyridine-2-carboxylic acid

C15H14N2O4 — CID 63641845

IUPAC6-[(2-methoxy-2-phenylacetyl)amino]pyridine-2-carboxylic acid
SMILESCOC(C(=O)Nc1cccc(C(=O)O)n1)c1ccccc1
InChIInChI=1S/C15H14N2O4/c1-21-13(10-6-3-2-4-7-10)14(18)17-12-9-5-8-11(16-12)15(19)20/h2-9,13H,1H3,(H,19,20)(H,16,17,18)
InChIKeyYPCNGCZSKDOMSA-UHFFFAOYSA-N
MW286.29 g/mol
LogP2.11
Rot. Bonds5

About 6-[(2-methoxy-2-phenylacetyl)amino]pyridine-2-carboxylic acid

6-[(2-methoxy-2-phenylacetyl)amino]pyridine-2-carboxylic acid (PubChem CID 63641845) has the molecular formula C15H14N2O4 and a molecular weight of 286.29 g/mol. Its IUPAC name is 6-[(2-methoxy-2-phenylacetyl)amino]pyridine-2-carboxylic acid.

Molecular Properties

Compound Name6-[(2-methoxy-2-phenylacetyl)amino]pyridine-2-carboxylic acid
PubChem CID63641845
Molecular FormulaC15H14N2O4
Molecular Weight286.29 g/mol
Exact Mass286.10
IUPAC Name6-[(2-methoxy-2-phenylacetyl)amino]pyridine-2-carboxylic acid
SMILESCOC(C(=O)Nc1cccc(C(=O)O)n1)c1ccccc1
InChIInChI=1S/C15H14N2O4/c1-21-13(10-6-3-2-4-7-10)14(18)17-12-9-5-8-11(16-12)15(19)20/h2-9,13H,1H3,(H,19,20)(H,16,17,18)
InChIKeyYPCNGCZSKDOMSA-UHFFFAOYSA-N
XLogP2.11
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 ≤ 52.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-[(2-methoxy-2-phenylacetyl)amino]pyridine-2-carboxylic acid?
The IUPAC name of 6-[(2-methoxy-2-phenylacetyl)amino]pyridine-2-carboxylic acid (CID 63641845) is 6-[(2-methoxy-2-phenylacetyl)amino]pyridine-2-carboxylic acid.
What is the SMILES notation for 6-[(2-methoxy-2-phenylacetyl)amino]pyridine-2-carboxylic acid?
The canonical SMILES for 6-[(2-methoxy-2-phenylacetyl)amino]pyridine-2-carboxylic acid is COC(C(=O)Nc1cccc(C(=O)O)n1)c1ccccc1.
What is the InChIKey of 6-[(2-methoxy-2-phenylacetyl)amino]pyridine-2-carboxylic acid?
The InChIKey is YPCNGCZSKDOMSA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14N2O4/c1-21-13(10-6-3-2-4-7-10)14(18)17-12-9-5-8-11(16-12)15(19)20/h2-9,13H,1H3,(H,19,20)(H,16,17,18).
What are the key properties of 6-[(2-methoxy-2-phenylacetyl)amino]pyridine-2-carboxylic acid?
6-[(2-methoxy-2-phenylacetyl)amino]pyridine-2-carboxylic acid has a molecular weight of 286.29 g/mol, XLogP of 2.11, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[(2-methoxy-2-phenylacetyl)amino]pyridine-2-carboxylic acid is sourced from PubChem (CID 63641845), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).