5-(5-methyl-3-nitrosoimidazo[1,2-a]pyridin-2-yl)-1,3-dihydroindol-2-one

C16H12N4O2 — CID 82356528

IUPAC5-(5-methyl-3-nitrosoimidazo[1,2-a]pyridin-2-yl)-1,3-dihydroindol-2-one
SMILESCc1cccc2nc(-c3ccc4c(c3)CC(=O)N4)c(N=O)n12
InChIInChI=1S/C16H12N4O2/c1-9-3-2-4-13-18-15(16(19-22)20(9)13)10-5-6-12-11(7-10)8-14(21)17-12/h2-7H,8H2,1H3,(H,17,21)
InChIKeyAMKJQJXPQXDKLH-UHFFFAOYSA-N
MW292.30 g/mol
LogP3.20
Rot. Bonds2

About 5-(5-methyl-3-nitrosoimidazo[1,2-a]pyridin-2-yl)-1,3-dihydroindol-2-one

5-(5-methyl-3-nitrosoimidazo[1,2-a]pyridin-2-yl)-1,3-dihydroindol-2-one (PubChem CID 82356528) has the molecular formula C16H12N4O2 and a molecular weight of 292.30 g/mol. Its IUPAC name is 5-(5-methyl-3-nitrosoimidazo[1,2-a]pyridin-2-yl)-1,3-dihydroindol-2-one.

Molecular Properties

Compound Name5-(5-methyl-3-nitrosoimidazo[1,2-a]pyridin-2-yl)-1,3-dihydroindol-2-one
PubChem CID82356528
Molecular FormulaC16H12N4O2
Molecular Weight292.30 g/mol
Exact Mass292.10
IUPAC Name5-(5-methyl-3-nitrosoimidazo[1,2-a]pyridin-2-yl)-1,3-dihydroindol-2-one
SMILESCc1cccc2nc(-c3ccc4c(c3)CC(=O)N4)c(N=O)n12
InChIInChI=1S/C16H12N4O2/c1-9-3-2-4-13-18-15(16(19-22)20(9)13)10-5-6-12-11(7-10)8-14(21)17-12/h2-7H,8H2,1H3,(H,17,21)
InChIKeyAMKJQJXPQXDKLH-UHFFFAOYSA-N
XLogP3.20
TPSA75.83 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.30
LogP ≤ 53.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

5-(7-methyl-3-nitrosoimidazo[1,2-a]pyridin-2-yl)-1,3-dihydroindol-2-one
CID 82356402
2-(4-tert-butylphenyl)-5-methyl-3-nitrosoimidazo[1,2-a]pyridine
CID 82356481
5-(3-aminoimidazo[1,2-a]pyridin-2-yl)-1,3-dihydroindol-2-one
CID 82355772
3-(2-oxo-1,3-dihydroindol-5-yl)pyrazine-2-carboxylic acid
CID 82482165
2-methyl-4-(2-oxo-1,3-dihydroindol-5-yl)-1,3-thiazole-5-carbonitrile
CID 116867086
5-(2-acetyl-6-methylpyrimidin-4-yl)-1,3-dihydroindol-2-one
CID 116895355
5-(2-ethyl-6-methylphenyl)-1,3-dihydroindol-2-one
CID 122662664
5-(2-phenylimidazo[1,2-a]pyrazin-3-yl)-1,3-dihydroindol-2-one
CID 122656101
5-[2-methyl-3-(pyrrolidin-1-ylmethyl)phenyl]-1,3-dihydroindol-2-one
CID 162045284
5-(2-methyl-5-sulfanylphenyl)-1,3-dihydroindol-2-one
CID 146227564
5-(2-amino-5-ethyl-1,3-oxazol-4-yl)-1,3-dihydroindol-2-one
CID 116831905
ethane;5-methyl-1,3-dihydroindol-2-one
CID 91234498

Frequently Asked Questions

What is the IUPAC name of 5-(5-methyl-3-nitrosoimidazo[1,2-a]pyridin-2-yl)-1,3-dihydroindol-2-one?
The IUPAC name of 5-(5-methyl-3-nitrosoimidazo[1,2-a]pyridin-2-yl)-1,3-dihydroindol-2-one (CID 82356528) is 5-(5-methyl-3-nitrosoimidazo[1,2-a]pyridin-2-yl)-1,3-dihydroindol-2-one.
What is the SMILES notation for 5-(5-methyl-3-nitrosoimidazo[1,2-a]pyridin-2-yl)-1,3-dihydroindol-2-one?
The canonical SMILES for 5-(5-methyl-3-nitrosoimidazo[1,2-a]pyridin-2-yl)-1,3-dihydroindol-2-one is Cc1cccc2nc(-c3ccc4c(c3)CC(=O)N4)c(N=O)n12.
What is the InChIKey of 5-(5-methyl-3-nitrosoimidazo[1,2-a]pyridin-2-yl)-1,3-dihydroindol-2-one?
The InChIKey is AMKJQJXPQXDKLH-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H12N4O2/c1-9-3-2-4-13-18-15(16(19-22)20(9)13)10-5-6-12-11(7-10)8-14(21)17-12/h2-7H,8H2,1H3,(H,17,21).
What are the key properties of 5-(5-methyl-3-nitrosoimidazo[1,2-a]pyridin-2-yl)-1,3-dihydroindol-2-one?
5-(5-methyl-3-nitrosoimidazo[1,2-a]pyridin-2-yl)-1,3-dihydroindol-2-one has a molecular weight of 292.30 g/mol, XLogP of 3.20, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(5-methyl-3-nitrosoimidazo[1,2-a]pyridin-2-yl)-1,3-dihydroindol-2-one is sourced from PubChem (CID 82356528), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).