N-(2,3-dioxo-1H-indol-7-yl)acetamide

C10H8N2O3 — CID 131596537

IUPACN-(2,3-dioxo-1H-indol-7-yl)acetamide
SMILESCC(=O)Nc1cccc2c1NC(=O)C2=O
InChIInChI=1S/C10H8N2O3/c1-5(13)11-7-4-2-3-6-8(7)12-10(15)9(6)14/h2-4H,1H3,(H,11,13)(H,12,14,15)
InChIKeyBVQLNYOGGJMKGJ-UHFFFAOYSA-N
MW204.19 g/mol
LogP0.78
Rot. Bonds1

About N-(2,3-dioxo-1H-indol-7-yl)acetamide

N-(2,3-dioxo-1H-indol-7-yl)acetamide (PubChem CID 131596537) has the molecular formula C10H8N2O3 and a molecular weight of 204.19 g/mol. Its IUPAC name is N-(2,3-dioxo-1H-indol-7-yl)acetamide.

Molecular Properties

Compound NameN-(2,3-dioxo-1H-indol-7-yl)acetamide
PubChem CID131596537
Molecular FormulaC10H8N2O3
Molecular Weight204.19 g/mol
Exact Mass204.05
IUPAC NameN-(2,3-dioxo-1H-indol-7-yl)acetamide
SMILESCC(=O)Nc1cccc2c1NC(=O)C2=O
InChIInChI=1S/C10H8N2O3/c1-5(13)11-7-4-2-3-6-8(7)12-10(15)9(6)14/h2-4H,1H3,(H,11,13)(H,12,14,15)
InChIKeyBVQLNYOGGJMKGJ-UHFFFAOYSA-N
XLogP0.78
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.19
LogP ≤ 50.78
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'diketo_group', 'substructure': 'N/A'}

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Related Compounds

N-(1,3,4-trioxoisoquinolin-5-yl)acetamide
CID 11572178
7-chloro-1H-indole-2,3-dione
CID 139078100
N-[4-(2,3-dioxo-1H-indol-7-yl)but-3-enyl]acetamide
CID 170489428
N-(1,1,3-trioxo-1,2-benzothiazol-7-yl)acetamide
CID 22099331
N-(4,4-dimethyl-2-oxo-1,3-dihydroquinolin-8-yl)acetamide
CID 57177979
7-(3-methylbut-2-enyl)-1H-indole-2,3-dione
CID 122397888
N-(6-hydroxy-2,3-dioxo-1H-indol-5-yl)acetamide
CID 119088471
N-(9-methylidene-10-oxoanthracen-1-yl)acetamide
CID 138614732
N-(9,9'-spirobi[fluorene]-1-yl)acetamide
CID 175536540
N-(1,3-dioxo-2-benzofuran-4-yl)acetamide;ethane
CID 143956506
N-(1,3-dihydro-2,1,3-benzothiadiazol-4-yl)acetamide
CID 1204329
N-(6-bromo-7-methyl-5,8-dioxonaphthalen-1-yl)acetamide
CID 70291421

Frequently Asked Questions

What is the IUPAC name of N-(2,3-dioxo-1H-indol-7-yl)acetamide?
The IUPAC name of N-(2,3-dioxo-1H-indol-7-yl)acetamide (CID 131596537) is N-(2,3-dioxo-1H-indol-7-yl)acetamide.
What is the SMILES notation for N-(2,3-dioxo-1H-indol-7-yl)acetamide?
The canonical SMILES for N-(2,3-dioxo-1H-indol-7-yl)acetamide is CC(=O)Nc1cccc2c1NC(=O)C2=O.
What is the InChIKey of N-(2,3-dioxo-1H-indol-7-yl)acetamide?
The InChIKey is BVQLNYOGGJMKGJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8N2O3/c1-5(13)11-7-4-2-3-6-8(7)12-10(15)9(6)14/h2-4H,1H3,(H,11,13)(H,12,14,15).
What are the key properties of N-(2,3-dioxo-1H-indol-7-yl)acetamide?
N-(2,3-dioxo-1H-indol-7-yl)acetamide has a molecular weight of 204.19 g/mol, XLogP of 0.78, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,3-dioxo-1H-indol-7-yl)acetamide is sourced from PubChem (CID 131596537), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).