4-hydroxy-N-(3-hydroxy-2-pyridinyl)-2-oxo-1H-quinoline-3-carboxamide

C15H11N3O4 — CID 54679496

IUPAC4-hydroxy-N-(3-hydroxy-2-pyridinyl)-2-oxo-1H-quinoline-3-carboxamide
SMILESO=C(Nc1ncccc1O)c1c(O)c2ccccc2[nH]c1=O
InChIInChI=1S/C15H11N3O4/c19-10-6-3-7-16-13(10)18-15(22)11-12(20)8-4-1-2-5-9(8)17-14(11)21/h1-7,19H,(H,16,18,22)(H2,17,20,21)
InChIKeyWFBZVTNERBMNAV-UHFFFAOYSA-N
MW297.27 g/mol
LogP1.59
Rot. Bonds2

About 4-hydroxy-N-(3-hydroxy-2-pyridinyl)-2-oxo-1H-quinoline-3-carboxamide

4-hydroxy-N-(3-hydroxy-2-pyridinyl)-2-oxo-1H-quinoline-3-carboxamide (PubChem CID 54679496) has the molecular formula C15H11N3O4 and a molecular weight of 297.27 g/mol. Its IUPAC name is 4-hydroxy-N-(3-hydroxy-2-pyridinyl)-2-oxo-1H-quinoline-3-carboxamide.

Molecular Properties

Compound Name4-hydroxy-N-(3-hydroxy-2-pyridinyl)-2-oxo-1H-quinoline-3-carboxamide
PubChem CID54679496
Molecular FormulaC15H11N3O4
Molecular Weight297.27 g/mol
Exact Mass297.07
IUPAC Name4-hydroxy-N-(3-hydroxy-2-pyridinyl)-2-oxo-1H-quinoline-3-carboxamide
SMILESO=C(Nc1ncccc1O)c1c(O)c2ccccc2[nH]c1=O
InChIInChI=1S/C15H11N3O4/c19-10-6-3-7-16-13(10)18-15(22)11-12(20)8-4-1-2-5-9(8)17-14(11)21/h1-7,19H,(H,16,18,22)(H2,17,20,21)
InChIKeyWFBZVTNERBMNAV-UHFFFAOYSA-N
XLogP1.59
TPSA115.31 Ų
H-Bond Donors4
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.27
LogP ≤ 51.59
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 105

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Related Compounds

5'-Hydroxypiroxicam
CID 54676301
1-ethyl-4-hydroxy-N-(3-hydroxypyridin-2-yl)-2-oxo-1,2-dihydroquinoline-3-carboxamide
CID 54682087
2-hydroxy-N-(3-hydroxypyridin-2-yl)-1-methyl-4-oxoquinoline-3-carboxamide
CID 54676454
1-Hydroxy-3-oxo-6,7-dihydro-3H,5H-pyrido[3,2,1-ij]quinoline-2-carboxylic acid pyridin-2-ylamide
CID 54683759
4-hydroxy-N-(3-hydroxypyridin-2-yl)-2-oxo-1-(prop-2-en-1-yl)-1,2-dihydroquinoline-3-carboxamide
CID 54683809
4-hydroxy-1-methyl-2-oxo-N-(pyridin-2-yl)-1,2-dihydroquinoline-3-carboxamide
CID 54684094
1-ethyl-4-hydroxy-2-oxo-N-(pyridin-2-yl)-1,2-dihydroquinoline-3-carboxamide
CID 54684095
4-hydroxy-N-(3-hydroxy-2-pyridyl)-1-isobutyl-2-keto-5,6,7,8-tetrahydroquinoline-3-carboxamide
CID 54686950
1-[3,5-Bis(trifluoromethyl)phenyl]-3-(3-hydroxypyridin-2-yl)urea
CID 57398245
4-hydroxy-N-(3-hydroxypyridin-2-yl)-2-oxo-1-propyl-1,2-dihydroquinoline-3-carboxamide
CID 54679520
4-hydroxy-1-methyl-2-oxo-N-(pyrimidin-2-yl)-1,2-dihydroquinoline-3-carboxamide
CID 54678750
1-butyl-4-hydroxy-N-(3-methyl-2-pyridinyl)-2-oxo-3-quinolinecarboxamide
CID 54676094

Frequently Asked Questions

What is the IUPAC name of 4-hydroxy-N-(3-hydroxy-2-pyridinyl)-2-oxo-1H-quinoline-3-carboxamide?
The IUPAC name of 4-hydroxy-N-(3-hydroxy-2-pyridinyl)-2-oxo-1H-quinoline-3-carboxamide (CID 54679496) is 4-hydroxy-N-(3-hydroxy-2-pyridinyl)-2-oxo-1H-quinoline-3-carboxamide.
What is the SMILES notation for 4-hydroxy-N-(3-hydroxy-2-pyridinyl)-2-oxo-1H-quinoline-3-carboxamide?
The canonical SMILES for 4-hydroxy-N-(3-hydroxy-2-pyridinyl)-2-oxo-1H-quinoline-3-carboxamide is O=C(Nc1ncccc1O)c1c(O)c2ccccc2[nH]c1=O.
What is the InChIKey of 4-hydroxy-N-(3-hydroxy-2-pyridinyl)-2-oxo-1H-quinoline-3-carboxamide?
The InChIKey is WFBZVTNERBMNAV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11N3O4/c19-10-6-3-7-16-13(10)18-15(22)11-12(20)8-4-1-2-5-9(8)17-14(11)21/h1-7,19H,(H,16,18,22)(H2,17,20,21).
What are the key properties of 4-hydroxy-N-(3-hydroxy-2-pyridinyl)-2-oxo-1H-quinoline-3-carboxamide?
4-hydroxy-N-(3-hydroxy-2-pyridinyl)-2-oxo-1H-quinoline-3-carboxamide has a molecular weight of 297.27 g/mol, XLogP of 1.59, 2 rotatable bonds, 4 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-hydroxy-N-(3-hydroxy-2-pyridinyl)-2-oxo-1H-quinoline-3-carboxamide is sourced from PubChem (CID 54679496), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).