2-oxo-1H-quinoline-4-carbohydrazide

C10H9N3O2 — CID 676699

IUPAC2-oxo-1H-quinoline-4-carbohydrazide
SMILESNNC(=O)c1cc(=O)[nH]c2ccccc12
InChIInChI=1S/C10H9N3O2/c11-13-10(15)7-5-9(14)12-8-4-2-1-3-6(7)8/h1-5H,11H2,(H,12,14)(H,13,15)
InChIKeyUWVVABCGQLHBQY-UHFFFAOYSA-N
MW203.20 g/mol
LogP0.13
Rot. Bonds1

About 2-oxo-1H-quinoline-4-carbohydrazide

2-oxo-1H-quinoline-4-carbohydrazide (PubChem CID 676699) has the molecular formula C10H9N3O2 and a molecular weight of 203.20 g/mol. Its IUPAC name is 2-oxo-1H-quinoline-4-carbohydrazide.

Molecular Properties

Compound Name2-oxo-1H-quinoline-4-carbohydrazide
PubChem CID676699
Molecular FormulaC10H9N3O2
Molecular Weight203.20 g/mol
Exact Mass203.07
IUPAC Name2-oxo-1H-quinoline-4-carbohydrazide
SMILESNNC(=O)c1cc(=O)[nH]c2ccccc12
InChIInChI=1S/C10H9N3O2/c11-13-10(15)7-5-9(14)12-8-4-2-1-3-6(7)8/h1-5H,11H2,(H,12,14)(H,13,15)
InChIKeyUWVVABCGQLHBQY-UHFFFAOYSA-N
XLogP0.13
TPSA87.98 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.20
LogP ≤ 50.13
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyl_hydrazine', '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-[(2R)-1-aminopropan-2-yl]-2-oxo-1H-quinoline-4-carboxamide
CID 104872786
methanamine;2-oxo-1H-quinoline-4-carboxylic acid
CID 143703164
N-[2-(methylamino)-2-oxoethyl]-2-oxo-1H-quinoline-4-carboxamide
CID 2542774
N-[(2S)-butan-2-yl]-2-oxo-1H-quinoline-4-carboxamide
CID 94065123
N-[(4-fluorophenyl)methyl]-2-oxo-1H-quinoline-4-carboxamide
CID 3617215
N-(3-methylbutan-2-yl)-2-oxo-1H-quinoline-4-carboxamide
CID 75409323
N-(4-carbamoylphenyl)-2-oxo-1H-quinoline-4-carboxamide
CID 8840546
N-(2-ethylphenyl)-2-oxo-1H-quinoline-4-carboxamide
CID 6456887
ethyl 4-[(2-oxo-1H-quinoline-4-carbonyl)amino]butanoate
CID 37262146
N-(1-amino-4-methylpentan-2-yl)-2-oxo-1H-quinoline-4-carboxamide
CID 63887542
N-[(2R)-2-hydroxy-2-phenylethyl]-2-oxo-1H-quinoline-4-carboxamide
CID 28934807
N-[3-(dimethylamino)propyl]-2-oxo-1H-quinoline-4-carboxamide
CID 110694434

Frequently Asked Questions

What is the IUPAC name of 2-oxo-1H-quinoline-4-carbohydrazide?
The IUPAC name of 2-oxo-1H-quinoline-4-carbohydrazide (CID 676699) is 2-oxo-1H-quinoline-4-carbohydrazide.
What is the SMILES notation for 2-oxo-1H-quinoline-4-carbohydrazide?
The canonical SMILES for 2-oxo-1H-quinoline-4-carbohydrazide is NNC(=O)c1cc(=O)[nH]c2ccccc12.
What is the InChIKey of 2-oxo-1H-quinoline-4-carbohydrazide?
The InChIKey is UWVVABCGQLHBQY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9N3O2/c11-13-10(15)7-5-9(14)12-8-4-2-1-3-6(7)8/h1-5H,11H2,(H,12,14)(H,13,15).
What are the key properties of 2-oxo-1H-quinoline-4-carbohydrazide?
2-oxo-1H-quinoline-4-carbohydrazide has a molecular weight of 203.20 g/mol, XLogP of 0.13, 1 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-oxo-1H-quinoline-4-carbohydrazide is sourced from PubChem (CID 676699), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).