1-(5-bromo-3-methyl-2-pyridinyl)-5-(methylamino)-3H-indol-2-one

C15H14BrN3O — CID 115148506

IUPAC1-(5-bromo-3-methyl-2-pyridinyl)-5-(methylamino)-3H-indol-2-one
SMILESCNc1ccc2c(c1)CC(=O)N2c1ncc(Br)cc1C
InChIInChI=1S/C15H14BrN3O/c1-9-5-11(16)8-18-15(9)19-13-4-3-12(17-2)6-10(13)7-14(19)20/h3-6,8,17H,7H2,1-2H3
InChIKeyMLOVKIJFOLXQSZ-UHFFFAOYSA-N
MW332.20 g/mol
LogP3.42
Rot. Bonds2

About 1-(5-bromo-3-methyl-2-pyridinyl)-5-(methylamino)-3H-indol-2-one

1-(5-bromo-3-methyl-2-pyridinyl)-5-(methylamino)-3H-indol-2-one (PubChem CID 115148506) has the molecular formula C15H14BrN3O and a molecular weight of 332.20 g/mol. Its IUPAC name is 1-(5-bromo-3-methyl-2-pyridinyl)-5-(methylamino)-3H-indol-2-one.

Molecular Properties

Compound Name1-(5-bromo-3-methyl-2-pyridinyl)-5-(methylamino)-3H-indol-2-one
PubChem CID115148506
Molecular FormulaC15H14BrN3O
Molecular Weight332.20 g/mol
Exact Mass331.03
IUPAC Name1-(5-bromo-3-methyl-2-pyridinyl)-5-(methylamino)-3H-indol-2-one
SMILESCNc1ccc2c(c1)CC(=O)N2c1ncc(Br)cc1C
InChIInChI=1S/C15H14BrN3O/c1-9-5-11(16)8-18-15(9)19-13-4-3-12(17-2)6-10(13)7-14(19)20/h3-6,8,17H,7H2,1-2H3
InChIKeyMLOVKIJFOLXQSZ-UHFFFAOYSA-N
XLogP3.42
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.20
LogP ≤ 53.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 1-(5-bromo-3-methyl-2-pyridinyl)-5-(methylamino)-3H-indol-2-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-(5-bromo-3-methyl-2-pyridinyl)-4H-isoquinoline-1,3-dione
CID 83170627
1-ethyl-5-(methylamino)-3H-indol-2-one
CID 82551072
1-(aminomethyl)-5-(methylamino)-3H-indol-2-one
CID 115225548
5-(methylamino)-2-oxo-3H-indole-1-carbonyl cyanide
CID 115172000
6-(cyclopropylamino)-2-[2-fluoro-4-(methylamino)phenyl]-4H-isoquinoline-1,3-dione
CID 142210614
3-[5-(methylamino)-2-oxo-3H-indol-1-yl]cyclobutane-1-carboxylic acid
CID 117042878
1-[[1-(aminomethyl)cyclopropyl]methyl]-5-(methylamino)-3H-indol-2-one
CID 115243978
5-bromo-1-phenyl-3H-indol-2-one
CID 139061933
[1-(5-bromo-3-methyl-2-pyridinyl)azetidin-3-yl]methanol
CID 79718833
(E)-4-[5-(methylamino)-2-oxo-3H-indol-1-yl]but-2-enoic acid
CID 115236990
1-(5-bromo-3-methyl-2-pyridinyl)-N-methylpiperidine-4-carboxamide
CID 112698998
1-(5-bromo-3-methyl-2-pyridinyl)-5-oxopyrrolidine-3-sulfonyl chloride
CID 168711824

Frequently Asked Questions

What is the IUPAC name of 1-(5-bromo-3-methyl-2-pyridinyl)-5-(methylamino)-3H-indol-2-one?
The IUPAC name of 1-(5-bromo-3-methyl-2-pyridinyl)-5-(methylamino)-3H-indol-2-one (CID 115148506) is 1-(5-bromo-3-methyl-2-pyridinyl)-5-(methylamino)-3H-indol-2-one.
What is the SMILES notation for 1-(5-bromo-3-methyl-2-pyridinyl)-5-(methylamino)-3H-indol-2-one?
The canonical SMILES for 1-(5-bromo-3-methyl-2-pyridinyl)-5-(methylamino)-3H-indol-2-one is CNc1ccc2c(c1)CC(=O)N2c1ncc(Br)cc1C.
What is the InChIKey of 1-(5-bromo-3-methyl-2-pyridinyl)-5-(methylamino)-3H-indol-2-one?
The InChIKey is MLOVKIJFOLXQSZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14BrN3O/c1-9-5-11(16)8-18-15(9)19-13-4-3-12(17-2)6-10(13)7-14(19)20/h3-6,8,17H,7H2,1-2H3.
What are the key properties of 1-(5-bromo-3-methyl-2-pyridinyl)-5-(methylamino)-3H-indol-2-one?
1-(5-bromo-3-methyl-2-pyridinyl)-5-(methylamino)-3H-indol-2-one has a molecular weight of 332.20 g/mol, XLogP of 3.42, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-bromo-3-methyl-2-pyridinyl)-5-(methylamino)-3H-indol-2-one is sourced from PubChem (CID 115148506), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).