2-oxo-2-(3-oxo-2,4-dihydroquinoxalin-1-yl)acetohydrazide

C10H10N4O3 — CID 43164015

IUPAC2-oxo-2-(3-oxo-2,4-dihydroquinoxalin-1-yl)acetohydrazide
SMILESNNC(=O)C(=O)N1CC(=O)Nc2ccccc21
InChIInChI=1S/C10H10N4O3/c11-13-9(16)10(17)14-5-8(15)12-6-3-1-2-4-7(6)14/h1-4H,5,11H2,(H,12,15)(H,13,16)
InChIKeyGVLXPWFDACPAPN-UHFFFAOYSA-N
MW234.22 g/mol
LogP-1.04
Rot. Bonds

About 2-oxo-2-(3-oxo-2,4-dihydroquinoxalin-1-yl)acetohydrazide

2-oxo-2-(3-oxo-2,4-dihydroquinoxalin-1-yl)acetohydrazide (PubChem CID 43164015) has the molecular formula C10H10N4O3 and a molecular weight of 234.22 g/mol. Its IUPAC name is 2-oxo-2-(3-oxo-2,4-dihydroquinoxalin-1-yl)acetohydrazide.

Molecular Properties

Compound Name2-oxo-2-(3-oxo-2,4-dihydroquinoxalin-1-yl)acetohydrazide
PubChem CID43164015
Molecular FormulaC10H10N4O3
Molecular Weight234.22 g/mol
Exact Mass234.08
IUPAC Name2-oxo-2-(3-oxo-2,4-dihydroquinoxalin-1-yl)acetohydrazide
SMILESNNC(=O)C(=O)N1CC(=O)Nc2ccccc21
InChIInChI=1S/C10H10N4O3/c11-13-9(16)10(17)14-5-8(15)12-6-3-1-2-4-7(6)14/h1-4H,5,11H2,(H,12,15)(H,13,16)
InChIKeyGVLXPWFDACPAPN-UHFFFAOYSA-N
XLogP-1.04
TPSA104.53 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.22
LogP ≤ 5-1.04
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

N-(2-aminoethyl)-2-oxo-2-(3-oxo-2,4-dihydroquinoxalin-1-yl)acetamide
CID 43316103
4-(2,2,2-trifluoroacetyl)-1,3-dihydroquinoxalin-2-one
CID 4749914
4-[1-(aminomethyl)cyclopropanecarbonyl]-1,3-dihydroquinoxalin-2-one
CID 80587760
2-(3-oxo-2,4-dihydroquinoxalin-1-yl)propanehydrazide
CID 63571192
2-hydroxyethyl 3-oxo-2,4-dihydroquinoxaline-1-carboxylate
CID 79345427
[(2S)-1-oxo-1-(3-oxo-2,4-dihydroquinoxalin-1-yl)propan-2-yl]urea
CID 95040569
4-(2-bromopropanoyl)-1,3-dihydroquinoxalin-2-one
CID 107902910
4-(2-nitrosoacetyl)-1,3-dihydroquinoxalin-2-one
CID 54465544
1-[4-(3-oxo-2,4-dihydroquinoxaline-1-carbonyl)phenyl]-2-phenylethane-1,2-dione
CID 2445640
N-amino-N'-butyl-3-oxo-2,4-dihydroquinoxaline-1-carboximidamide
CID 116513050
4-(2-amino-2-ethylbutanoyl)-1,3-dihydroquinoxalin-2-one
CID 79810105
4-[(2S)-2-amino-3,3-dimethylbutanoyl]-1,3-dihydroquinoxalin-2-one
CID 61148811

Frequently Asked Questions

What is the IUPAC name of 2-oxo-2-(3-oxo-2,4-dihydroquinoxalin-1-yl)acetohydrazide?
The IUPAC name of 2-oxo-2-(3-oxo-2,4-dihydroquinoxalin-1-yl)acetohydrazide (CID 43164015) is 2-oxo-2-(3-oxo-2,4-dihydroquinoxalin-1-yl)acetohydrazide.
What is the SMILES notation for 2-oxo-2-(3-oxo-2,4-dihydroquinoxalin-1-yl)acetohydrazide?
The canonical SMILES for 2-oxo-2-(3-oxo-2,4-dihydroquinoxalin-1-yl)acetohydrazide is NNC(=O)C(=O)N1CC(=O)Nc2ccccc21.
What is the InChIKey of 2-oxo-2-(3-oxo-2,4-dihydroquinoxalin-1-yl)acetohydrazide?
The InChIKey is GVLXPWFDACPAPN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10N4O3/c11-13-9(16)10(17)14-5-8(15)12-6-3-1-2-4-7(6)14/h1-4H,5,11H2,(H,12,15)(H,13,16).
What are the key properties of 2-oxo-2-(3-oxo-2,4-dihydroquinoxalin-1-yl)acetohydrazide?
2-oxo-2-(3-oxo-2,4-dihydroquinoxalin-1-yl)acetohydrazide has a molecular weight of 234.22 g/mol, XLogP of -1.04, 0 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-oxo-2-(3-oxo-2,4-dihydroquinoxalin-1-yl)acetohydrazide is sourced from PubChem (CID 43164015), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).