N-(3-bromo-4-pyridinyl)-2-oxo-1,3-dihydroindole-5-carboxamide

C14H10BrN3O2 — CID 103874392

IUPACN-(3-bromo-4-pyridinyl)-2-oxo-1,3-dihydroindole-5-carboxamide
SMILESO=C1Cc2cc(C(=O)Nc3ccncc3Br)ccc2N1
InChIInChI=1S/C14H10BrN3O2/c15-10-7-16-4-3-12(10)18-14(20)8-1-2-11-9(5-8)6-13(19)17-11/h1-5,7H,6H2,(H,17,19)(H,16,18,20)
InChIKeyIRTUMIIZNCFNSU-UHFFFAOYSA-N
MW332.16 g/mol
LogP2.59
Rot. Bonds2

About N-(3-bromo-4-pyridinyl)-2-oxo-1,3-dihydroindole-5-carboxamide

N-(3-bromo-4-pyridinyl)-2-oxo-1,3-dihydroindole-5-carboxamide (PubChem CID 103874392) has the molecular formula C14H10BrN3O2 and a molecular weight of 332.16 g/mol. Its IUPAC name is N-(3-bromo-4-pyridinyl)-2-oxo-1,3-dihydroindole-5-carboxamide.

Molecular Properties

Compound NameN-(3-bromo-4-pyridinyl)-2-oxo-1,3-dihydroindole-5-carboxamide
PubChem CID103874392
Molecular FormulaC14H10BrN3O2
Molecular Weight332.16 g/mol
Exact Mass331.00
IUPAC NameN-(3-bromo-4-pyridinyl)-2-oxo-1,3-dihydroindole-5-carboxamide
SMILESO=C1Cc2cc(C(=O)Nc3ccncc3Br)ccc2N1
InChIInChI=1S/C14H10BrN3O2/c15-10-7-16-4-3-12(10)18-14(20)8-1-2-11-9(5-8)6-13(19)17-11/h1-5,7H,6H2,(H,17,19)(H,16,18,20)
InChIKeyIRTUMIIZNCFNSU-UHFFFAOYSA-N
XLogP2.59
TPSA71.09 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.16
LogP ≤ 52.59
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(3-bromo-4-pyridinyl)-2-oxo-3,4-dihydro-1H-quinoline-6-carboxamide
CID 103857166
N-(4-methyl-3-pyridinyl)-2-oxo-1,3-dihydroindole-6-carboxamide
CID 102712374
N-(3,5-dimethylphenyl)-2-oxo-1,3-dihydroindole-5-carboxamide
CID 110700387
2-oxo-N-(2,3,4-trifluorophenyl)-1,3-dihydroindole-5-carboxamide
CID 110700473
N-(5-amino-2-pyridinyl)-2-oxo-1,3-dihydroindole-5-carboxamide
CID 115273678
4-bromo-N-(3-bromo-4-pyridinyl)-3-methylbenzamide
CID 112548050
N-(3,4-difluorophenyl)-2-oxo-1,3-dihydroindole-5-carboxamide
CID 110700475
N-(2,3-dimethyl-5-sulfamoylphenyl)-2-oxo-1,3-dihydroindole-5-carboxamide
CID 167928666
N-(3-bromo-4-pyridinyl)-4-chloro-3-fluorobenzamide
CID 113343605
methyl 4-chloro-3-[(2-oxo-1,3-dihydroindole-5-carbonyl)amino]benzoate
CID 110700432
N-[4-[(4,6-dimethylpyrimidin-2-yl)amino]phenyl]-2-oxo-1,3-dihydroindole-5-carboxamide
CID 108797937
N-[3-(dimethylamino)phenyl]-2-oxo-1,3-dihydroindole-5-carboxamide
CID 108784695

Frequently Asked Questions

What is the IUPAC name of N-(3-bromo-4-pyridinyl)-2-oxo-1,3-dihydroindole-5-carboxamide?
The IUPAC name of N-(3-bromo-4-pyridinyl)-2-oxo-1,3-dihydroindole-5-carboxamide (CID 103874392) is N-(3-bromo-4-pyridinyl)-2-oxo-1,3-dihydroindole-5-carboxamide.
What is the SMILES notation for N-(3-bromo-4-pyridinyl)-2-oxo-1,3-dihydroindole-5-carboxamide?
The canonical SMILES for N-(3-bromo-4-pyridinyl)-2-oxo-1,3-dihydroindole-5-carboxamide is O=C1Cc2cc(C(=O)Nc3ccncc3Br)ccc2N1.
What is the InChIKey of N-(3-bromo-4-pyridinyl)-2-oxo-1,3-dihydroindole-5-carboxamide?
The InChIKey is IRTUMIIZNCFNSU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10BrN3O2/c15-10-7-16-4-3-12(10)18-14(20)8-1-2-11-9(5-8)6-13(19)17-11/h1-5,7H,6H2,(H,17,19)(H,16,18,20).
What are the key properties of N-(3-bromo-4-pyridinyl)-2-oxo-1,3-dihydroindole-5-carboxamide?
N-(3-bromo-4-pyridinyl)-2-oxo-1,3-dihydroindole-5-carboxamide has a molecular weight of 332.16 g/mol, XLogP of 2.59, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-bromo-4-pyridinyl)-2-oxo-1,3-dihydroindole-5-carboxamide is sourced from PubChem (CID 103874392), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).