2-methyl-N-[2-oxo-2-[2-(pyridine-3-carbonyl)hydrazinyl]ethyl]benzamide

C16H16N4O3 — CID 51163103

IUPAC2-methyl-N-[2-oxo-2-[2-(pyridine-3-carbonyl)hydrazinyl]ethyl]benzamide
SMILESCc1ccccc1C(=O)NCC(=O)NNC(=O)c1cccnc1
InChIInChI=1S/C16H16N4O3/c1-11-5-2-3-7-13(11)16(23)18-10-14(21)19-20-15(22)12-6-4-8-17-9-12/h2-9H,10H2,1H3,(H,18,23)(H,19,21)(H,20,22)
InChIKeyOSDGABVZFPQZKC-UHFFFAOYSA-N
MW312.33 g/mol
LogP0.58
Rot. Bonds4

About 2-methyl-N-[2-oxo-2-[2-(pyridine-3-carbonyl)hydrazinyl]ethyl]benzamide

2-methyl-N-[2-oxo-2-[2-(pyridine-3-carbonyl)hydrazinyl]ethyl]benzamide (PubChem CID 51163103) has the molecular formula C16H16N4O3 and a molecular weight of 312.33 g/mol. Its IUPAC name is 2-methyl-N-[2-oxo-2-[2-(pyridine-3-carbonyl)hydrazinyl]ethyl]benzamide.

Molecular Properties

Compound Name2-methyl-N-[2-oxo-2-[2-(pyridine-3-carbonyl)hydrazinyl]ethyl]benzamide
PubChem CID51163103
Molecular FormulaC16H16N4O3
Molecular Weight312.33 g/mol
Exact Mass312.12
IUPAC Name2-methyl-N-[2-oxo-2-[2-(pyridine-3-carbonyl)hydrazinyl]ethyl]benzamide
SMILESCc1ccccc1C(=O)NCC(=O)NNC(=O)c1cccnc1
InChIInChI=1S/C16H16N4O3/c1-11-5-2-3-7-13(11)16(23)18-10-14(21)19-20-15(22)12-6-4-8-17-9-12/h2-9H,10H2,1H3,(H,18,23)(H,19,21)(H,20,22)
InChIKeyOSDGABVZFPQZKC-UHFFFAOYSA-N
XLogP0.58
TPSA100.19 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.33
LogP ≤ 50.58
H-Bond Donors ≤ 53
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-methylbenzoyl)amino]ethyl]pyridine-3-carboxamide
CID 2985921
N-[3-[(2-methylbenzoyl)amino]propyl]pyridine-3-carboxamide
CID 2992500
N'-[2-(2-methylphenyl)acetyl]pyridine-3-carbohydrazide
CID 35152193
4-bromo-N-[2-oxo-2-[2-(pyridine-3-carbonyl)hydrazinyl]ethyl]benzamide
CID 35151089
2-fluoro-N-[2-[2-(2-methylbenzoyl)hydrazinyl]-2-oxoethyl]benzamide
CID 9220655
N-[[4-[(pyridine-3-carbonylamino)carbamoyl]phenyl]methyl]acetamide
CID 32688575
N-[2-[2-(cyclopropanecarbonyl)hydrazinyl]-2-oxoethyl]-2-methylbenzamide
CID 51165990
N-[2-(4-methylanilino)-2-oxoethyl]pyridine-3-carboxamide
CID 110705464
N-(2-hydrazinyl-2-oxoethyl)pyridine-3-carboxamide
CID 39070404
N'-(4-oxo-4-phenylbutanoyl)pyridine-3-carbohydrazide
CID 35152458
N-[2-[(2-benzamidoacetyl)amino]phenyl]pyridine-3-carboxamide
CID 108925269
N-[2-(2,4-dimethylanilino)-2-oxoethyl]pyridine-3-carboxamide
CID 110705466

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-[2-oxo-2-[2-(pyridine-3-carbonyl)hydrazinyl]ethyl]benzamide?
The IUPAC name of 2-methyl-N-[2-oxo-2-[2-(pyridine-3-carbonyl)hydrazinyl]ethyl]benzamide (CID 51163103) is 2-methyl-N-[2-oxo-2-[2-(pyridine-3-carbonyl)hydrazinyl]ethyl]benzamide.
What is the SMILES notation for 2-methyl-N-[2-oxo-2-[2-(pyridine-3-carbonyl)hydrazinyl]ethyl]benzamide?
The canonical SMILES for 2-methyl-N-[2-oxo-2-[2-(pyridine-3-carbonyl)hydrazinyl]ethyl]benzamide is Cc1ccccc1C(=O)NCC(=O)NNC(=O)c1cccnc1.
What is the InChIKey of 2-methyl-N-[2-oxo-2-[2-(pyridine-3-carbonyl)hydrazinyl]ethyl]benzamide?
The InChIKey is OSDGABVZFPQZKC-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16N4O3/c1-11-5-2-3-7-13(11)16(23)18-10-14(21)19-20-15(22)12-6-4-8-17-9-12/h2-9H,10H2,1H3,(H,18,23)(H,19,21)(H,20,22).
What are the key properties of 2-methyl-N-[2-oxo-2-[2-(pyridine-3-carbonyl)hydrazinyl]ethyl]benzamide?
2-methyl-N-[2-oxo-2-[2-(pyridine-3-carbonyl)hydrazinyl]ethyl]benzamide has a molecular weight of 312.33 g/mol, XLogP of 0.58, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-[2-oxo-2-[2-(pyridine-3-carbonyl)hydrazinyl]ethyl]benzamide is sourced from PubChem (CID 51163103), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).