2-[2-hydroxy-5-[(2-methoxyacetyl)amino]phenyl]pyridine-4-carboxylic acid

C15H14N2O5 — CID 135567037

IUPAC2-[2-hydroxy-5-[(2-methoxyacetyl)amino]phenyl]pyridine-4-carboxylic acid
SMILESCOCC(=O)Nc1ccc(O)c(-c2cc(C(=O)O)ccn2)c1
InChIInChI=1S/C15H14N2O5/c1-22-8-14(19)17-10-2-3-13(18)11(7-10)12-6-9(15(20)21)4-5-16-12/h2-7,18H,8H2,1H3,(H,17,19)(H,20,21)
InChIKeyHHHINYOXTBYXCI-UHFFFAOYSA-N
MW302.29 g/mol
LogP1.74
Rot. Bonds5

About 2-[2-hydroxy-5-[(2-methoxyacetyl)amino]phenyl]pyridine-4-carboxylic acid

2-[2-hydroxy-5-[(2-methoxyacetyl)amino]phenyl]pyridine-4-carboxylic acid (PubChem CID 135567037) has the molecular formula C15H14N2O5 and a molecular weight of 302.29 g/mol. Its IUPAC name is 2-[2-hydroxy-5-[(2-methoxyacetyl)amino]phenyl]pyridine-4-carboxylic acid.

Molecular Properties

Compound Name2-[2-hydroxy-5-[(2-methoxyacetyl)amino]phenyl]pyridine-4-carboxylic acid
PubChem CID135567037
Molecular FormulaC15H14N2O5
Molecular Weight302.29 g/mol
Exact Mass302.09
IUPAC Name2-[2-hydroxy-5-[(2-methoxyacetyl)amino]phenyl]pyridine-4-carboxylic acid
SMILESCOCC(=O)Nc1ccc(O)c(-c2cc(C(=O)O)ccn2)c1
InChIInChI=1S/C15H14N2O5/c1-22-8-14(19)17-10-2-3-13(18)11(7-10)12-6-9(15(20)21)4-5-16-12/h2-7,18H,8H2,1H3,(H,17,19)(H,20,21)
InChIKeyHHHINYOXTBYXCI-UHFFFAOYSA-N
XLogP1.74
TPSA108.75 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.29
LogP ≤ 51.74
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

2-[5-[(4-Hydroxyphenyl)carbonylamino]-2-Oxidanyl-Phenyl]pyridine-4-Carboxylic Acid
CID 135567041
2-[5-[2-(3-Methoxyphenyl)ethanoylamino]-2-Oxidanyl-Phenyl]pyridine-4-Carboxylic Acid
CID 135567042
2-(5-Azanyl-2-Oxidanyl-Phenyl)pyridine-4-Carboxylic Acid
CID 135567039
2-(5-Acetamido-2-Oxidanyl-Phenyl)pyridine-4-Carboxylic Acid
CID 135567040
2-[2-Hydroxy-5-[(3-hydroxybenzoyl)amino]phenyl]pyridine-4-carboxylic acid
CID 136053701
2-[2-Hydroxy-5-[(2-phenylacetyl)amino]phenyl]pyridine-4-carboxylic acid
CID 136053702
2-[5-[[2-(3-Bromophenyl)acetyl]amino]-2-hydroxyphenyl]pyridine-4-carboxylic acid
CID 136053703
2-[2-Hydroxy-5-[[2-(4-methoxyphenyl)acetyl]amino]phenyl]pyridine-4-carboxylic acid
CID 136053704
(S)-3-(4-Hydroxy-phenyl)-2-[(pyridine-2-carbonyl)-amino]-propionic acid ethyl ester
CID 44281525
2-[2-Hydroxy-5-[(2-hydroxybenzoyl)amino]phenyl]pyridine-4-carboxylic acid
CID 136053700
2-[2-Hydroxy-5-(1,2-oxazole-5-carbonylamino)phenyl]pyridine-4-carboxylic acid
CID 136053705
2-[5-[(4-Bromophenyl)methylamino]-2-hydroxyphenyl]pyridine-4-carboxylic acid
CID 136053708

Frequently Asked Questions

What is the IUPAC name of 2-[2-hydroxy-5-[(2-methoxyacetyl)amino]phenyl]pyridine-4-carboxylic acid?
The IUPAC name of 2-[2-hydroxy-5-[(2-methoxyacetyl)amino]phenyl]pyridine-4-carboxylic acid (CID 135567037) is 2-[2-hydroxy-5-[(2-methoxyacetyl)amino]phenyl]pyridine-4-carboxylic acid.
What is the SMILES notation for 2-[2-hydroxy-5-[(2-methoxyacetyl)amino]phenyl]pyridine-4-carboxylic acid?
The canonical SMILES for 2-[2-hydroxy-5-[(2-methoxyacetyl)amino]phenyl]pyridine-4-carboxylic acid is COCC(=O)Nc1ccc(O)c(-c2cc(C(=O)O)ccn2)c1.
What is the InChIKey of 2-[2-hydroxy-5-[(2-methoxyacetyl)amino]phenyl]pyridine-4-carboxylic acid?
The InChIKey is HHHINYOXTBYXCI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14N2O5/c1-22-8-14(19)17-10-2-3-13(18)11(7-10)12-6-9(15(20)21)4-5-16-12/h2-7,18H,8H2,1H3,(H,17,19)(H,20,21).
What are the key properties of 2-[2-hydroxy-5-[(2-methoxyacetyl)amino]phenyl]pyridine-4-carboxylic acid?
2-[2-hydroxy-5-[(2-methoxyacetyl)amino]phenyl]pyridine-4-carboxylic acid has a molecular weight of 302.29 g/mol, XLogP of 1.74, 5 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-hydroxy-5-[(2-methoxyacetyl)amino]phenyl]pyridine-4-carboxylic acid is sourced from PubChem (CID 135567037), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).