1-[(3,4-difluorophenyl)methyl]-2-oxo-N-[2-oxo-3-(2-oxo-1,3-dihydroindol-5-yl)propyl]pyridine-3-carboxamide

C24H19F2N3O4 — CID 147069175

IUPAC1-[(3,4-difluorophenyl)methyl]-2-oxo-N-[2-oxo-3-(2-oxo-1,3-dihydroindol-5-yl)propyl]pyridine-3-carboxamide
SMILESO=C(CNC(=O)c1cccn(Cc2ccc(F)c(F)c2)c1=O)Cc1ccc2c(c1)CC(=O)N2
InChIInChI=1S/C24H19F2N3O4/c25-19-5-3-15(10-20(19)26)13-29-7-1-2-18(24(29)33)23(32)27-12-17(30)9-14-4-6-21-16(8-14)11-22(31)28-21/h1-8,10H,9,11-13H2,(H,27,32)(H,28,31)
InChIKeyBERYZANYGFECEU-UHFFFAOYSA-N
MW451.43 g/mol
LogP2.21
Rot. Bonds7

About 1-[(3,4-difluorophenyl)methyl]-2-oxo-N-[2-oxo-3-(2-oxo-1,3-dihydroindol-5-yl)propyl]pyridine-3-carboxamide

1-[(3,4-difluorophenyl)methyl]-2-oxo-N-[2-oxo-3-(2-oxo-1,3-dihydroindol-5-yl)propyl]pyridine-3-carboxamide (PubChem CID 147069175) has the molecular formula C24H19F2N3O4 and a molecular weight of 451.43 g/mol. Its IUPAC name is 1-[(3,4-difluorophenyl)methyl]-2-oxo-N-[2-oxo-3-(2-oxo-1,3-dihydroindol-5-yl)propyl]pyridine-3-carboxamide.

Molecular Properties

Compound Name1-[(3,4-difluorophenyl)methyl]-2-oxo-N-[2-oxo-3-(2-oxo-1,3-dihydroindol-5-yl)propyl]pyridine-3-carboxamide
PubChem CID147069175
Molecular FormulaC24H19F2N3O4
Molecular Weight451.43 g/mol
Exact Mass451.13
IUPAC Name1-[(3,4-difluorophenyl)methyl]-2-oxo-N-[2-oxo-3-(2-oxo-1,3-dihydroindol-5-yl)propyl]pyridine-3-carboxamide
SMILESO=C(CNC(=O)c1cccn(Cc2ccc(F)c(F)c2)c1=O)Cc1ccc2c(c1)CC(=O)N2
InChIInChI=1S/C24H19F2N3O4/c25-19-5-3-15(10-20(19)26)13-29-7-1-2-18(24(29)33)23(32)27-12-17(30)9-14-4-6-21-16(8-14)11-22(31)28-21/h1-8,10H,9,11-13H2,(H,27,32)(H,28,31)
InChIKeyBERYZANYGFECEU-UHFFFAOYSA-N
XLogP2.21
TPSA97.27 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms33
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500451.43
LogP ≤ 52.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

1-[(3,4-difluorophenyl)methyl]-N-[2,2-dimethyl-3-oxo-3-[(2-oxo-1,3-dihydroindol-5-yl)amino]propyl]-N-methyl-2-oxopyridine-3-carboxamide
CID 145414579
[3-[[[1-[(3,4-difluorophenyl)methyl]-2-oxopyridine-3-carbonyl]amino]methyl]phenyl]boronic acid
CID 59362353
2-oxo-N-[(E,1S)-3-(2-oxo-1,3-dihydroindol-5-yl)-1-phenylprop-2-enyl]-1-[(3,4,5-trifluorophenyl)methyl]pyridine-3-carboxamide
CID 157110199
4-[(3,4-difluorophenyl)methyl]-3-oxo-N-[(1R)-2-[(2-oxo-1,3-dihydroindol-5-yl)oxy]-1-phenylethyl]pyrazine-2-carboxamide
CID 58443048
N-[2-(4-fluorophenyl)ethyl]-2-(2-oxo-1,3-dihydroindol-5-yl)acetamide
CID 110768108
N-(7-bromo-1,2,3,4-tetrahydronaphthalen-1-yl)-1-[(3,4-difluorophenyl)methyl]-2-oxopyridine-3-carboxamide
CID 140551893
1-[(3,4-difluorophenyl)methyl]-2-oxo-N-[[3-(1H-pyrazol-4-yl)phenyl]methyl]pyridine-3-carboxamide
CID 59362777
2-(2-oxo-1,3-dihydroindol-5-yl)-N-(2,3,4-trifluorophenyl)acetamide
CID 110768234
2-(2-oxo-1,3-dihydroindol-5-yl)-N-prop-2-enylacetamide
CID 110768065
1-[(3,4-difluorophenyl)methyl]-N-[[5-(1H-isoindol-5-yl)thiophen-2-yl]methyl]-2-oxopyridine-3-carboxamide
CID 159081235
1-[(3,4-difluorophenyl)methyl]-3-[4-[4-(2-oxopropyl)phenoxy]butanoyl]pyridin-2-one
CID 159666432
1,3-difluoro-2-nitrobenzene;1-[(3,4-difluorophenyl)methyl]-N-[2-fluoro-6-[(2-oxo-1,3-dihydroindol-6-yl)oxy]phenyl]-2-oxopyridine-3-carboxamide;1,3-dihydroindol-2-one;ethane;6-(3-fluoro-2-nitrophenoxy)-1,3-dihydroindol-2-one;6-hydroxy-1,3-dihydroindol-2-one
CID 158195427

Frequently Asked Questions

What is the IUPAC name of 1-[(3,4-difluorophenyl)methyl]-2-oxo-N-[2-oxo-3-(2-oxo-1,3-dihydroindol-5-yl)propyl]pyridine-3-carboxamide?
The IUPAC name of 1-[(3,4-difluorophenyl)methyl]-2-oxo-N-[2-oxo-3-(2-oxo-1,3-dihydroindol-5-yl)propyl]pyridine-3-carboxamide (CID 147069175) is 1-[(3,4-difluorophenyl)methyl]-2-oxo-N-[2-oxo-3-(2-oxo-1,3-dihydroindol-5-yl)propyl]pyridine-3-carboxamide.
What is the SMILES notation for 1-[(3,4-difluorophenyl)methyl]-2-oxo-N-[2-oxo-3-(2-oxo-1,3-dihydroindol-5-yl)propyl]pyridine-3-carboxamide?
The canonical SMILES for 1-[(3,4-difluorophenyl)methyl]-2-oxo-N-[2-oxo-3-(2-oxo-1,3-dihydroindol-5-yl)propyl]pyridine-3-carboxamide is O=C(CNC(=O)c1cccn(Cc2ccc(F)c(F)c2)c1=O)Cc1ccc2c(c1)CC(=O)N2.
What is the InChIKey of 1-[(3,4-difluorophenyl)methyl]-2-oxo-N-[2-oxo-3-(2-oxo-1,3-dihydroindol-5-yl)propyl]pyridine-3-carboxamide?
The InChIKey is BERYZANYGFECEU-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H19F2N3O4/c25-19-5-3-15(10-20(19)26)13-29-7-1-2-18(24(29)33)23(32)27-12-17(30)9-14-4-6-21-16(8-14)11-22(31)28-21/h1-8,10H,9,11-13H2,(H,27,32)(H,28,31).
What are the key properties of 1-[(3,4-difluorophenyl)methyl]-2-oxo-N-[2-oxo-3-(2-oxo-1,3-dihydroindol-5-yl)propyl]pyridine-3-carboxamide?
1-[(3,4-difluorophenyl)methyl]-2-oxo-N-[2-oxo-3-(2-oxo-1,3-dihydroindol-5-yl)propyl]pyridine-3-carboxamide has a molecular weight of 451.43 g/mol, XLogP of 2.21, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(3,4-difluorophenyl)methyl]-2-oxo-N-[2-oxo-3-(2-oxo-1,3-dihydroindol-5-yl)propyl]pyridine-3-carboxamide is sourced from PubChem (CID 147069175), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).