N-[5-[hydroxy(oxido)amino]-2-oxo-1,3-dihydroindol-6-yl]acetamide

C10H10N3O4- — CID 163177449

IUPACN-[5-[hydroxy(oxido)amino]-2-oxo-1,3-dihydroindol-6-yl]acetamide
SMILESCC(=O)Nc1cc2c(cc1N([O-])O)CC(=O)N2
InChIInChI=1S/C10H10N3O4/c1-5(14)11-8-4-7-6(3-10(15)12-7)2-9(8)13(16)17/h2,4,16H,3H2,1H3,(H,11,14)(H,12,15)/q-1
InChIKeyNPSZRSQCUPEJMC-UHFFFAOYSA-N
MW236.21 g/mol
LogP0.83
Rot. Bonds2

About N-[5-[hydroxy(oxido)amino]-2-oxo-1,3-dihydroindol-6-yl]acetamide

N-[5-[hydroxy(oxido)amino]-2-oxo-1,3-dihydroindol-6-yl]acetamide (PubChem CID 163177449) has the molecular formula C10H10N3O4- and a molecular weight of 236.21 g/mol. Its IUPAC name is N-[5-[hydroxy(oxido)amino]-2-oxo-1,3-dihydroindol-6-yl]acetamide.

Molecular Properties

Compound NameN-[5-[hydroxy(oxido)amino]-2-oxo-1,3-dihydroindol-6-yl]acetamide
PubChem CID163177449
Molecular FormulaC10H10N3O4-
Molecular Weight236.21 g/mol
Exact Mass236.07
IUPAC NameN-[5-[hydroxy(oxido)amino]-2-oxo-1,3-dihydroindol-6-yl]acetamide
SMILESCC(=O)Nc1cc2c(cc1N([O-])O)CC(=O)N2
InChIInChI=1S/C10H10N3O4/c1-5(14)11-8-4-7-6(3-10(15)12-7)2-9(8)13(16)17/h2,4,16H,3H2,1H3,(H,11,14)(H,12,15)/q-1
InChIKeyNPSZRSQCUPEJMC-UHFFFAOYSA-N
XLogP0.83
TPSA104.73 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.21
LogP ≤ 50.83
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

N-[2-[(5-nitro-2-oxo-1,3-dihydroindol-6-yl)amino]ethyl]acetamide
CID 43552851
N-(5-fluoro-2-oxo-1,3-dihydroindol-6-yl)-2-hydroxypropanamide
CID 66607967
N-(6-chloro-2-oxo-1,3-dihydroindol-5-yl)-4-hydroxypentanamide
CID 79200976
5-amino-6-(1-hydroxypropan-2-ylamino)-1,3-dihydroindol-2-one
CID 43498919
N-(5-methyl-2-oxo-1,3-dihydroindol-6-yl)formamide
CID 23439064
3-(tert-butylamino)-N-(6-chloro-2-oxo-1,3-dihydroindol-5-yl)propanamide
CID 60849399
6-methyl-2-oxo-1,3-dihydroindole-5-carboxylic acid
CID 59216572
N-[3-(2-oxo-1,3-dihydroindole-5-carbonyl)phenyl]acetamide
CID 68698490
3-[(5-amino-2-oxo-1,3-dihydroindol-6-yl)amino]-2,2-dimethylpropanamide
CID 106275147
6-[[1-hydroxy-2-(hydroxymethyl)butan-2-yl]amino]-5-nitro-1,3-dihydroindol-2-one
CID 107866131
5-amino-6-(butan-2-ylamino)-1,3-dihydroindol-2-one
CID 43451662
5-amino-6-(2-aminoethylamino)-1,3-dihydroindol-2-one
CID 62480998

Frequently Asked Questions

What is the IUPAC name of N-[5-[hydroxy(oxido)amino]-2-oxo-1,3-dihydroindol-6-yl]acetamide?
The IUPAC name of N-[5-[hydroxy(oxido)amino]-2-oxo-1,3-dihydroindol-6-yl]acetamide (CID 163177449) is N-[5-[hydroxy(oxido)amino]-2-oxo-1,3-dihydroindol-6-yl]acetamide.
What is the SMILES notation for N-[5-[hydroxy(oxido)amino]-2-oxo-1,3-dihydroindol-6-yl]acetamide?
The canonical SMILES for N-[5-[hydroxy(oxido)amino]-2-oxo-1,3-dihydroindol-6-yl]acetamide is CC(=O)Nc1cc2c(cc1N([O-])O)CC(=O)N2.
What is the InChIKey of N-[5-[hydroxy(oxido)amino]-2-oxo-1,3-dihydroindol-6-yl]acetamide?
The InChIKey is NPSZRSQCUPEJMC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10N3O4/c1-5(14)11-8-4-7-6(3-10(15)12-7)2-9(8)13(16)17/h2,4,16H,3H2,1H3,(H,11,14)(H,12,15)/q-1.
What are the key properties of N-[5-[hydroxy(oxido)amino]-2-oxo-1,3-dihydroindol-6-yl]acetamide?
N-[5-[hydroxy(oxido)amino]-2-oxo-1,3-dihydroindol-6-yl]acetamide has a molecular weight of 236.21 g/mol, XLogP of 0.83, 2 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-[hydroxy(oxido)amino]-2-oxo-1,3-dihydroindol-6-yl]acetamide is sourced from PubChem (CID 163177449), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).