N-(1-acetyl-2,3-dihydroindol-6-yl)-6-oxo-1H-pyridine-3-carboxamide

C16H15N3O3 — CID 110627246

IUPACN-(1-acetyl-2,3-dihydroindol-6-yl)-6-oxo-1H-pyridine-3-carboxamide
SMILESCC(=O)N1CCc2ccc(NC(=O)c3ccc(=O)[nH]c3)cc21
InChIInChI=1S/C16H15N3O3/c1-10(20)19-7-6-11-2-4-13(8-14(11)19)18-16(22)12-3-5-15(21)17-9-12/h2-5,8-9H,6-7H2,1H3,(H,17,21)(H,18,22)
InChIKeyQBZQVPKTSOQTMB-UHFFFAOYSA-N
MW297.31 g/mol
LogP1.54
Rot. Bonds2

About N-(1-acetyl-2,3-dihydroindol-6-yl)-6-oxo-1H-pyridine-3-carboxamide

N-(1-acetyl-2,3-dihydroindol-6-yl)-6-oxo-1H-pyridine-3-carboxamide (PubChem CID 110627246) has the molecular formula C16H15N3O3 and a molecular weight of 297.31 g/mol. Its IUPAC name is N-(1-acetyl-2,3-dihydroindol-6-yl)-6-oxo-1H-pyridine-3-carboxamide.

Molecular Properties

Compound NameN-(1-acetyl-2,3-dihydroindol-6-yl)-6-oxo-1H-pyridine-3-carboxamide
PubChem CID110627246
Molecular FormulaC16H15N3O3
Molecular Weight297.31 g/mol
Exact Mass297.11
IUPAC NameN-(1-acetyl-2,3-dihydroindol-6-yl)-6-oxo-1H-pyridine-3-carboxamide
SMILESCC(=O)N1CCc2ccc(NC(=O)c3ccc(=O)[nH]c3)cc21
InChIInChI=1S/C16H15N3O3/c1-10(20)19-7-6-11-2-4-13(8-14(11)19)18-16(22)12-3-5-15(21)17-9-12/h2-5,8-9H,6-7H2,1H3,(H,17,21)(H,18,22)
InChIKeyQBZQVPKTSOQTMB-UHFFFAOYSA-N
XLogP1.54
TPSA82.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.31
LogP ≤ 51.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

6-oxo-N-[1-(pyridine-3-carbonyl)-3,4-dihydro-2H-quinolin-7-yl]-1H-pyridine-3-carboxamide
CID 110623360
N-(1-acetyl-2,3-dihydroindol-6-yl)-4,5,6,7-tetrahydro-1H-indazole-3-carboxamide
CID 110627216
N-(1-acetyl-3,4-dihydro-2H-quinolin-7-yl)-3,5-dimethylbenzamide
CID 7586167
N-(1-acetyl-3,4-dihydro-2H-quinolin-7-yl)-3,4-dimethoxybenzamide
CID 7586153
N-(1-acetyl-3,4-dihydro-2H-quinolin-7-yl)-3-fluorobenzamide
CID 7527164
1-acetyl-2,3-dihydroindole-6-carboxylic acid
CID 82609550
6-oxo-N-(3-oxo-1,2-dihydroisoindol-5-yl)-1H-pyridine-3-carboxamide
CID 75418529
N-(1-acetyl-2,3-dihydroindol-6-yl)-2-methyl-4-(3,3,3-trifluoroprop-1-enyl)benzamide
CID 68701762
N-(1-acetyl-3,4-dihydro-2H-quinolin-7-yl)-2-chlorobenzamide
CID 7527150
N-(1-acetyl-2,3-dihydroindol-5-yl)-4-(methylsulfamoyl)benzamide
CID 51219427
(1-acetyl-3,4-dihydro-2H-quinolin-7-yl)thiourea
CID 169358597
6-oxo-N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)-1H-pyridine-3-carboxamide
CID 26017164

Frequently Asked Questions

What is the IUPAC name of N-(1-acetyl-2,3-dihydroindol-6-yl)-6-oxo-1H-pyridine-3-carboxamide?
The IUPAC name of N-(1-acetyl-2,3-dihydroindol-6-yl)-6-oxo-1H-pyridine-3-carboxamide (CID 110627246) is N-(1-acetyl-2,3-dihydroindol-6-yl)-6-oxo-1H-pyridine-3-carboxamide.
What is the SMILES notation for N-(1-acetyl-2,3-dihydroindol-6-yl)-6-oxo-1H-pyridine-3-carboxamide?
The canonical SMILES for N-(1-acetyl-2,3-dihydroindol-6-yl)-6-oxo-1H-pyridine-3-carboxamide is CC(=O)N1CCc2ccc(NC(=O)c3ccc(=O)[nH]c3)cc21.
What is the InChIKey of N-(1-acetyl-2,3-dihydroindol-6-yl)-6-oxo-1H-pyridine-3-carboxamide?
The InChIKey is QBZQVPKTSOQTMB-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15N3O3/c1-10(20)19-7-6-11-2-4-13(8-14(11)19)18-16(22)12-3-5-15(21)17-9-12/h2-5,8-9H,6-7H2,1H3,(H,17,21)(H,18,22).
What are the key properties of N-(1-acetyl-2,3-dihydroindol-6-yl)-6-oxo-1H-pyridine-3-carboxamide?
N-(1-acetyl-2,3-dihydroindol-6-yl)-6-oxo-1H-pyridine-3-carboxamide has a molecular weight of 297.31 g/mol, XLogP of 1.54, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-acetyl-2,3-dihydroindol-6-yl)-6-oxo-1H-pyridine-3-carboxamide is sourced from PubChem (CID 110627246), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).