6-oxo-N-(3-oxo-1,2-dihydroisoindol-5-yl)-1H-pyridine-3-carboxamide

C14H11N3O3 — CID 75418529

IUPAC6-oxo-N-(3-oxo-1,2-dihydroisoindol-5-yl)-1H-pyridine-3-carboxamide
SMILESO=C(Nc1ccc2c(c1)C(=O)NC2)c1ccc(=O)[nH]c1
InChIInChI=1S/C14H11N3O3/c18-12-4-2-9(7-15-12)13(19)17-10-3-1-8-6-16-14(20)11(8)5-10/h1-5,7H,6H2,(H,15,18)(H,16,20)(H,17,19)
InChIKeyUBOTWELYXGUYOO-UHFFFAOYSA-N
MW269.26 g/mol
LogP0.87
Rot. Bonds2

About 6-oxo-N-(3-oxo-1,2-dihydroisoindol-5-yl)-1H-pyridine-3-carboxamide

6-oxo-N-(3-oxo-1,2-dihydroisoindol-5-yl)-1H-pyridine-3-carboxamide (PubChem CID 75418529) has the molecular formula C14H11N3O3 and a molecular weight of 269.26 g/mol. Its IUPAC name is 6-oxo-N-(3-oxo-1,2-dihydroisoindol-5-yl)-1H-pyridine-3-carboxamide.

Molecular Properties

Compound Name6-oxo-N-(3-oxo-1,2-dihydroisoindol-5-yl)-1H-pyridine-3-carboxamide
PubChem CID75418529
Molecular FormulaC14H11N3O3
Molecular Weight269.26 g/mol
Exact Mass269.08
IUPAC Name6-oxo-N-(3-oxo-1,2-dihydroisoindol-5-yl)-1H-pyridine-3-carboxamide
SMILESO=C(Nc1ccc2c(c1)C(=O)NC2)c1ccc(=O)[nH]c1
InChIInChI=1S/C14H11N3O3/c18-12-4-2-9(7-15-12)13(19)17-10-3-1-8-6-16-14(20)11(8)5-10/h1-5,7H,6H2,(H,15,18)(H,16,20)(H,17,19)
InChIKeyUBOTWELYXGUYOO-UHFFFAOYSA-N
XLogP0.87
TPSA91.06 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.26
LogP ≤ 50.87
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

N-(1,3-dioxoisoindol-5-yl)-6-oxo-1H-pyridine-3-carboxamide
CID 28834338
N-(4-fluorophenyl)-6-oxo-1H-pyridine-3-carboxamide
CID 8745096
6-oxo-N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)-1H-pyridine-3-carboxamide
CID 26017164
N-(1-acetyl-2,3-dihydroindol-6-yl)-6-oxo-1H-pyridine-3-carboxamide
CID 110627246
N-(4-bromo-3-fluorophenyl)-6-oxo-1H-pyridine-3-carboxamide
CID 65435783
4-tert-butyl-N-(1-oxo-3,4-dihydro-2H-isoquinolin-7-yl)benzamide
CID 90524768
2-methylsulfonyl-N-(3-oxo-1,2-dihydroisoindol-5-yl)benzamide
CID 86872690
methyl 4-[(1-oxo-3,4-dihydro-2H-isoquinolin-7-yl)carbamoyl]benzoate
CID 56764988
N-(4-cyanophenyl)-6-oxo-1H-pyridine-3-carboxamide
CID 8015151
N-[3-oxo-3-[(3-oxo-1,2-dihydroisoindol-5-yl)amino]propyl]naphthalene-2-carboxamide
CID 86872751
2-(4-acetamido-2-methylbenzoyl)-N-(3-oxo-1,2-dihydroisoindol-5-yl)-3,4-dihydro-1H-isoquinoline-7-carboxamide
CID 171706449
2-cyano-2-methyl-N-(3-oxo-1,2-dihydroisoindol-5-yl)propanamide
CID 75418530

Frequently Asked Questions

What is the IUPAC name of 6-oxo-N-(3-oxo-1,2-dihydroisoindol-5-yl)-1H-pyridine-3-carboxamide?
The IUPAC name of 6-oxo-N-(3-oxo-1,2-dihydroisoindol-5-yl)-1H-pyridine-3-carboxamide (CID 75418529) is 6-oxo-N-(3-oxo-1,2-dihydroisoindol-5-yl)-1H-pyridine-3-carboxamide.
What is the SMILES notation for 6-oxo-N-(3-oxo-1,2-dihydroisoindol-5-yl)-1H-pyridine-3-carboxamide?
The canonical SMILES for 6-oxo-N-(3-oxo-1,2-dihydroisoindol-5-yl)-1H-pyridine-3-carboxamide is O=C(Nc1ccc2c(c1)C(=O)NC2)c1ccc(=O)[nH]c1.
What is the InChIKey of 6-oxo-N-(3-oxo-1,2-dihydroisoindol-5-yl)-1H-pyridine-3-carboxamide?
The InChIKey is UBOTWELYXGUYOO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11N3O3/c18-12-4-2-9(7-15-12)13(19)17-10-3-1-8-6-16-14(20)11(8)5-10/h1-5,7H,6H2,(H,15,18)(H,16,20)(H,17,19).
What are the key properties of 6-oxo-N-(3-oxo-1,2-dihydroisoindol-5-yl)-1H-pyridine-3-carboxamide?
6-oxo-N-(3-oxo-1,2-dihydroisoindol-5-yl)-1H-pyridine-3-carboxamide has a molecular weight of 269.26 g/mol, XLogP of 0.87, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-oxo-N-(3-oxo-1,2-dihydroisoindol-5-yl)-1H-pyridine-3-carboxamide is sourced from PubChem (CID 75418529), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).