2,5-dimethyl-N'-[2-(2-oxo-1-pyridinyl)acetyl]benzohydrazide

C16H17N3O3 — CID 9077511

IUPAC2,5-dimethyl-N'-[2-(2-oxo-1-pyridinyl)acetyl]benzohydrazide
SMILESCc1ccc(C)c(C(=O)NNC(=O)Cn2ccccc2=O)c1
InChIInChI=1S/C16H17N3O3/c1-11-6-7-12(2)13(9-11)16(22)18-17-14(20)10-19-8-4-3-5-15(19)21/h3-9H,10H2,1-2H3,(H,17,20)(H,18,22)
InChIKeyJEAMVRUBQXRZJG-UHFFFAOYSA-N
MW299.33 g/mol
LogP0.93
Rot. Bonds3

About 2,5-dimethyl-N'-[2-(2-oxo-1-pyridinyl)acetyl]benzohydrazide

2,5-dimethyl-N'-[2-(2-oxo-1-pyridinyl)acetyl]benzohydrazide (PubChem CID 9077511) has the molecular formula C16H17N3O3 and a molecular weight of 299.33 g/mol. Its IUPAC name is 2,5-dimethyl-N'-[2-(2-oxo-1-pyridinyl)acetyl]benzohydrazide.

Molecular Properties

Compound Name2,5-dimethyl-N'-[2-(2-oxo-1-pyridinyl)acetyl]benzohydrazide
PubChem CID9077511
Molecular FormulaC16H17N3O3
Molecular Weight299.33 g/mol
Exact Mass299.13
IUPAC Name2,5-dimethyl-N'-[2-(2-oxo-1-pyridinyl)acetyl]benzohydrazide
SMILESCc1ccc(C)c(C(=O)NNC(=O)Cn2ccccc2=O)c1
InChIInChI=1S/C16H17N3O3/c1-11-6-7-12(2)13(9-11)16(22)18-17-14(20)10-19-8-4-3-5-15(19)21/h3-9H,10H2,1-2H3,(H,17,20)(H,18,22)
InChIKeyJEAMVRUBQXRZJG-UHFFFAOYSA-N
XLogP0.93
TPSA80.20 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.33
LogP ≤ 50.93
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

N'-[2-(2-oxo-1-pyridinyl)acetyl]benzohydrazide
CID 51176255
4-ethyl-N'-[2-(2-oxo-1-pyridinyl)acetyl]benzohydrazide
CID 78791798
N'-[2-(2-oxo-1-pyridinyl)acetyl]-4-phenylbenzohydrazide
CID 9077512
N'-[2-(3-benzyl-2,6-dioxopyrimidin-1-yl)acetyl]-2,4-dimethylbenzohydrazide
CID 9276978
3-methyl-N'-[2-(2-oxo-1-pyridinyl)acetyl]-1-benzofuran-2-carbohydrazide
CID 51177211
1-[2-(2-methylphenyl)-2-oxoethyl]pyridin-2-one
CID 62018988
2-(4-fluorophenyl)-N'-[2-(2-oxo-1-pyridinyl)acetyl]quinoline-4-carbohydrazide
CID 9077551
5-bromo-N'-[2-(2-oxo-1-pyridinyl)acetyl]pyridine-3-carbohydrazide
CID 9077503
2-chloro-N-[2-oxo-2-[2-[2-(2-oxo-1-pyridinyl)acetyl]hydrazinyl]ethyl]benzamide
CID 9077775
N'-[2-(2-oxo-1-pyridinyl)acetyl]-2,2-diphenylacetohydrazide
CID 9077513
N-[2-(2-methylphenyl)ethyl]-2-(2-oxo-1-pyridinyl)acetamide
CID 51177305
N,N-dimethyl-4-[[[2-(2-oxo-1-pyridinyl)acetyl]amino]carbamoyl]benzenesulfonamide
CID 9077663

Frequently Asked Questions

What is the IUPAC name of 2,5-dimethyl-N'-[2-(2-oxo-1-pyridinyl)acetyl]benzohydrazide?
The IUPAC name of 2,5-dimethyl-N'-[2-(2-oxo-1-pyridinyl)acetyl]benzohydrazide (CID 9077511) is 2,5-dimethyl-N'-[2-(2-oxo-1-pyridinyl)acetyl]benzohydrazide.
What is the SMILES notation for 2,5-dimethyl-N'-[2-(2-oxo-1-pyridinyl)acetyl]benzohydrazide?
The canonical SMILES for 2,5-dimethyl-N'-[2-(2-oxo-1-pyridinyl)acetyl]benzohydrazide is Cc1ccc(C)c(C(=O)NNC(=O)Cn2ccccc2=O)c1.
What is the InChIKey of 2,5-dimethyl-N'-[2-(2-oxo-1-pyridinyl)acetyl]benzohydrazide?
The InChIKey is JEAMVRUBQXRZJG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17N3O3/c1-11-6-7-12(2)13(9-11)16(22)18-17-14(20)10-19-8-4-3-5-15(19)21/h3-9H,10H2,1-2H3,(H,17,20)(H,18,22).
What are the key properties of 2,5-dimethyl-N'-[2-(2-oxo-1-pyridinyl)acetyl]benzohydrazide?
2,5-dimethyl-N'-[2-(2-oxo-1-pyridinyl)acetyl]benzohydrazide has a molecular weight of 299.33 g/mol, XLogP of 0.93, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,5-dimethyl-N'-[2-(2-oxo-1-pyridinyl)acetyl]benzohydrazide is sourced from PubChem (CID 9077511), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).