N-(2,2-dihydroxy-3-oxo-1H-indol-5-yl)acetamide

C10H10N2O4 — CID 91155555

IUPACN-(2,2-dihydroxy-3-oxo-1H-indol-5-yl)acetamide
SMILESCC(=O)Nc1ccc2c(c1)C(=O)C(O)(O)N2
InChIInChI=1S/C10H10N2O4/c1-5(13)11-6-2-3-8-7(4-6)9(14)10(15,16)12-8/h2-4,12,15-16H,1H3,(H,11,13)
InChIKeyFBNXIPGRDYYMCO-UHFFFAOYSA-N
MW222.20 g/mol
LogP-0.11
Rot. Bonds1

About N-(2,2-dihydroxy-3-oxo-1H-indol-5-yl)acetamide

N-(2,2-dihydroxy-3-oxo-1H-indol-5-yl)acetamide (PubChem CID 91155555) has the molecular formula C10H10N2O4 and a molecular weight of 222.20 g/mol. Its IUPAC name is N-(2,2-dihydroxy-3-oxo-1H-indol-5-yl)acetamide.

Molecular Properties

Compound NameN-(2,2-dihydroxy-3-oxo-1H-indol-5-yl)acetamide
PubChem CID91155555
Molecular FormulaC10H10N2O4
Molecular Weight222.20 g/mol
Exact Mass222.06
IUPAC NameN-(2,2-dihydroxy-3-oxo-1H-indol-5-yl)acetamide
SMILESCC(=O)Nc1ccc2c(c1)C(=O)C(O)(O)N2
InChIInChI=1S/C10H10N2O4/c1-5(13)11-6-2-3-8-7(4-6)9(14)10(15,16)12-8/h2-4,12,15-16H,1H3,(H,11,13)
InChIKeyFBNXIPGRDYYMCO-UHFFFAOYSA-N
XLogP-0.11
TPSA98.66 Ų
H-Bond Donors4
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.20
LogP ≤ 5-0.11
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Related Compounds

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CID 135839434
N-(9,10-dioxoanthracen-2-yl)acetamide;ethane
CID 143974024
N-(2-hydroxy-1,3-dioxoisoindol-5-yl)acetamide
CID 100916426
N-(3-methyl-2,3-dihydro-1H-indol-5-yl)acetamide
CID 119085478
N-(3-methyl-6-oxo-5H-benzo[b][1,4]benzoxazepin-8-yl)acetamide
CID 5297680
N-(2-oxo-5,6-dihydro-3H-benzo[f]cinnolin-9-yl)acetamide
CID 10244077
N-(6,11-dioxo-6a,7,8,9-tetrahydro-5H-pyrrolo[2,1-c][1,4]benzodiazepin-2-yl)acetamide
CID 71754883
N-[4-(methoxymethylidene)-1,3-dioxoisoquinolin-6-yl]acetamide
CID 68690731
N-(2,3-dioxo-1,4-dihydroquinoxalin-6-yl)acetamide
CID 60700393
N-(3-oxospiro[1-benzothiophene-2,1'-cyclopropane]-6-yl)acetamide
CID 12767920
N-[2-oxo-3-[(3,4,5-trimethoxyphenyl)methylidene]-1H-indol-5-yl]acetamide
CID 155758920
N-(16,18-dioxo-17-azapentacyclo[6.6.5.02,7.09,14.015,19]nonadeca-2(7),3,5,9,11,13-hexaen-4-yl)acetamide
CID 155554187

Frequently Asked Questions

What is the IUPAC name of N-(2,2-dihydroxy-3-oxo-1H-indol-5-yl)acetamide?
The IUPAC name of N-(2,2-dihydroxy-3-oxo-1H-indol-5-yl)acetamide (CID 91155555) is N-(2,2-dihydroxy-3-oxo-1H-indol-5-yl)acetamide.
What is the SMILES notation for N-(2,2-dihydroxy-3-oxo-1H-indol-5-yl)acetamide?
The canonical SMILES for N-(2,2-dihydroxy-3-oxo-1H-indol-5-yl)acetamide is CC(=O)Nc1ccc2c(c1)C(=O)C(O)(O)N2.
What is the InChIKey of N-(2,2-dihydroxy-3-oxo-1H-indol-5-yl)acetamide?
The InChIKey is FBNXIPGRDYYMCO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10N2O4/c1-5(13)11-6-2-3-8-7(4-6)9(14)10(15,16)12-8/h2-4,12,15-16H,1H3,(H,11,13).
What are the key properties of N-(2,2-dihydroxy-3-oxo-1H-indol-5-yl)acetamide?
N-(2,2-dihydroxy-3-oxo-1H-indol-5-yl)acetamide has a molecular weight of 222.20 g/mol, XLogP of -0.11, 1 rotatable bonds, 4 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,2-dihydroxy-3-oxo-1H-indol-5-yl)acetamide is sourced from PubChem (CID 91155555), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).