Isonicotinic acid, 2-(2-((m-methylbenzyl)carbamoyl)ethyl)hydrazide

HCID 27495

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Basic information

CAS: 15806-16-3
Standard SMILES: Cc1cccc(CNC(=O)CCNNC(=O)c2ccncc2)c1
InChIKey: HZGDDONUVNALST-UHFFFAOYSA-N
Molecular formula: C17H20N4O2
Average molar mass: 312.37 g/mol
Monoisotopic mass: 312.15862589

Names & identifiers

Preferred name: Isonicotinic acid, 2-(2-((m-methylbenzyl)carbamoyl)ethyl)hydrazide
IUPAC: N-[(3-methylphenyl)methyl]-3-[2-(pyridine-4-carbonyl)hydrazinyl]propanamide

Names & synonyms

P 1260BRN 0495118ISONICOTINIC ACID, 2-(2-((m-METHYLBENZYL)CARBAMOYL)ETHYL)HYDRAZIDE15806-16-3DTXSID90166361RefChem:349680DTXCID8088852N-[(3-Methylphenyl)methyl]-3-[2-(pyridine-4-carbonyl)hydrazin-1-yl]propanamide

Database identifiers

CAS: 15806-16-3
PubChem CID: 27495
DTXSID: DTXSID90166361

Properties

Computed structural properties

XLogP: 1.2
Topological polar surface area: 83.1 Å²
Hydrogen bond donors: 3
Hydrogen bond acceptors: 4
Rotatable bonds: 7
Heavy atoms: 23
Formal charge: 0
Complexity: 383

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