4-methoxy-N-[2-oxo-2-[2-(pyridine-4-carbonyl)hydrazinyl]ethyl]benzamide

C16H16N4O4 — CID 4628077

IUPAC4-methoxy-N-[2-oxo-2-[2-(pyridine-4-carbonyl)hydrazinyl]ethyl]benzamide
SMILESCOc1ccc(C(=O)NCC(=O)NNC(=O)c2ccncc2)cc1
InChIInChI=1S/C16H16N4O4/c1-24-13-4-2-11(3-5-13)15(22)18-10-14(21)19-20-16(23)12-6-8-17-9-7-12/h2-9H,10H2,1H3,(H,18,22)(H,19,21)(H,20,23)
InChIKeyAICGZLMIFSNPQQ-UHFFFAOYSA-N
MW328.33 g/mol
LogP0.28
Rot. Bonds5

About 4-methoxy-N-[2-oxo-2-[2-(pyridine-4-carbonyl)hydrazinyl]ethyl]benzamide

4-methoxy-N-[2-oxo-2-[2-(pyridine-4-carbonyl)hydrazinyl]ethyl]benzamide (PubChem CID 4628077) has the molecular formula C16H16N4O4 and a molecular weight of 328.33 g/mol. Its IUPAC name is 4-methoxy-N-[2-oxo-2-[2-(pyridine-4-carbonyl)hydrazinyl]ethyl]benzamide.

Molecular Properties

Compound Name4-methoxy-N-[2-oxo-2-[2-(pyridine-4-carbonyl)hydrazinyl]ethyl]benzamide
PubChem CID4628077
Molecular FormulaC16H16N4O4
Molecular Weight328.33 g/mol
Exact Mass328.12
IUPAC Name4-methoxy-N-[2-oxo-2-[2-(pyridine-4-carbonyl)hydrazinyl]ethyl]benzamide
SMILESCOc1ccc(C(=O)NCC(=O)NNC(=O)c2ccncc2)cc1
InChIInChI=1S/C16H16N4O4/c1-24-13-4-2-11(3-5-13)15(22)18-10-14(21)19-20-16(23)12-6-8-17-9-7-12/h2-9H,10H2,1H3,(H,18,22)(H,19,21)(H,20,23)
InChIKeyAICGZLMIFSNPQQ-UHFFFAOYSA-N
XLogP0.28
TPSA109.42 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.33
LogP ≤ 50.28
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

1-N',4-N'-bis(4-methoxybenzoyl)butanedihydrazide
CID 3140699
N-[2-(4-methoxyphenoxy)ethyl]pyridine-4-carboxamide
CID 27173434
N-[2-(methylamino)-2-oxoethyl]pyridine-4-carboxamide
CID 58188881
N-[2-(4-methoxyphenoxy)propyl]pyridine-4-carboxamide
CID 71994221
1-N',9-N'-bis(4-methoxybenzoyl)nonanedihydrazide
CID 3123941
N'-(4-ethoxybenzoyl)pyridine-4-carbohydrazide
CID 959949
2-[(4-methoxybenzoyl)amino]acetate
CID 6920131
N-[2-hydroxy-2-(4-methoxyphenyl)ethyl]pyridine-4-carboxamide
CID 47178909
N'-(3,3-dimethylbutanoyl)-4-methoxybenzohydrazide
CID 27169274
N-[2-oxo-2-[2-(4-propan-2-yloxybenzoyl)hydrazinyl]ethyl]benzamide
CID 43002548
N-[2-[[(2S)-1-hydroxy-3-oxobutan-2-yl]amino]-2-oxoethyl]-4-methoxybenzamide
CID 71129478
2-naphthalen-1-yl-N-[2-oxo-2-[2-(pyridine-4-carbonyl)hydrazinyl]ethyl]acetamide
CID 7677981

Frequently Asked Questions

What is the IUPAC name of 4-methoxy-N-[2-oxo-2-[2-(pyridine-4-carbonyl)hydrazinyl]ethyl]benzamide?
The IUPAC name of 4-methoxy-N-[2-oxo-2-[2-(pyridine-4-carbonyl)hydrazinyl]ethyl]benzamide (CID 4628077) is 4-methoxy-N-[2-oxo-2-[2-(pyridine-4-carbonyl)hydrazinyl]ethyl]benzamide.
What is the SMILES notation for 4-methoxy-N-[2-oxo-2-[2-(pyridine-4-carbonyl)hydrazinyl]ethyl]benzamide?
The canonical SMILES for 4-methoxy-N-[2-oxo-2-[2-(pyridine-4-carbonyl)hydrazinyl]ethyl]benzamide is COc1ccc(C(=O)NCC(=O)NNC(=O)c2ccncc2)cc1.
What is the InChIKey of 4-methoxy-N-[2-oxo-2-[2-(pyridine-4-carbonyl)hydrazinyl]ethyl]benzamide?
The InChIKey is AICGZLMIFSNPQQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16N4O4/c1-24-13-4-2-11(3-5-13)15(22)18-10-14(21)19-20-16(23)12-6-8-17-9-7-12/h2-9H,10H2,1H3,(H,18,22)(H,19,21)(H,20,23).
What are the key properties of 4-methoxy-N-[2-oxo-2-[2-(pyridine-4-carbonyl)hydrazinyl]ethyl]benzamide?
4-methoxy-N-[2-oxo-2-[2-(pyridine-4-carbonyl)hydrazinyl]ethyl]benzamide has a molecular weight of 328.33 g/mol, XLogP of 0.28, 5 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-N-[2-oxo-2-[2-(pyridine-4-carbonyl)hydrazinyl]ethyl]benzamide is sourced from PubChem (CID 4628077), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).