N-(2,5-difluoro-4-methylphenyl)-3-fluoro-2-hydrazinylpyridine-4-carboxamide

C13H11F3N4O — CID 103587401

IUPACN-(2,5-difluoro-4-methylphenyl)-3-fluoro-2-hydrazinylpyridine-4-carboxamide
SMILESCc1cc(F)c(NC(=O)c2ccnc(NN)c2F)cc1F
InChIInChI=1S/C13H11F3N4O/c1-6-4-9(15)10(5-8(6)14)19-13(21)7-2-3-18-12(20-17)11(7)16/h2-5H,17H2,1H3,(H,18,20)(H,19,21)
InChIKeyBLVSONGNUQYMDX-UHFFFAOYSA-N
MW296.25 g/mol
LogP2.35
Rot. Bonds3

About N-(2,5-difluoro-4-methylphenyl)-3-fluoro-2-hydrazinylpyridine-4-carboxamide

N-(2,5-difluoro-4-methylphenyl)-3-fluoro-2-hydrazinylpyridine-4-carboxamide (PubChem CID 103587401) has the molecular formula C13H11F3N4O and a molecular weight of 296.25 g/mol. Its IUPAC name is N-(2,5-difluoro-4-methylphenyl)-3-fluoro-2-hydrazinylpyridine-4-carboxamide.

Molecular Properties

Compound NameN-(2,5-difluoro-4-methylphenyl)-3-fluoro-2-hydrazinylpyridine-4-carboxamide
PubChem CID103587401
Molecular FormulaC13H11F3N4O
Molecular Weight296.25 g/mol
Exact Mass296.09
IUPAC NameN-(2,5-difluoro-4-methylphenyl)-3-fluoro-2-hydrazinylpyridine-4-carboxamide
SMILESCc1cc(F)c(NC(=O)c2ccnc(NN)c2F)cc1F
InChIInChI=1S/C13H11F3N4O/c1-6-4-9(15)10(5-8(6)14)19-13(21)7-2-3-18-12(20-17)11(7)16/h2-5H,17H2,1H3,(H,18,20)(H,19,21)
InChIKeyBLVSONGNUQYMDX-UHFFFAOYSA-N
XLogP2.35
TPSA80.04 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.25
LogP ≤ 52.35
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

N-(2,5-difluoro-4-methylphenyl)-2,3-difluoropyridine-4-carboxamide
CID 103585463
3-fluoro-N-(4-fluoro-2-methylphenyl)-2-hydrazinylpyridine-4-carboxamide
CID 105387986
N-(2,5-dimethylphenyl)-3-fluoro-2-hydrazinylpyridine-4-carboxamide
CID 105387954
3-fluoro-N-(4-fluoro-2-methoxyphenyl)-2-hydrazinylpyridine-4-carboxamide
CID 105388058
N-(2,5-difluoro-4-methylphenyl)-6-hydrazinylpyridine-3-carboxamide
CID 103587390
3-fluoro-N-(2-fluoro-4-methylphenyl)-2-(methylamino)pyridine-4-carboxamide
CID 105383951
N-(4-bromo-5-fluoro-2-methylphenyl)-3-fluoro-2-(methylamino)pyridine-4-carboxamide
CID 105387648
3-fluoro-2-hydrazinyl-N-(5-methyl-1,3,4-oxadiazol-2-yl)pyridine-4-carboxamide
CID 105388648
3-fluoro-2-hydrazinyl-N-(2-propylphenyl)pyridine-4-carboxamide
CID 105388094
3-fluoro-N-(3-fluorophenyl)-2-hydrazinylpyridine-4-carboxamide
CID 105387962
3-fluoro-2-hydrazinyl-N-(4-methyl-1,3-oxazol-2-yl)pyridine-4-carboxamide
CID 105388646
N-(5-chloro-2-methylphenyl)-3-fluoro-2-(methylamino)pyridine-4-carboxamide
CID 105383965

Frequently Asked Questions

What is the IUPAC name of N-(2,5-difluoro-4-methylphenyl)-3-fluoro-2-hydrazinylpyridine-4-carboxamide?
The IUPAC name of N-(2,5-difluoro-4-methylphenyl)-3-fluoro-2-hydrazinylpyridine-4-carboxamide (CID 103587401) is N-(2,5-difluoro-4-methylphenyl)-3-fluoro-2-hydrazinylpyridine-4-carboxamide.
What is the SMILES notation for N-(2,5-difluoro-4-methylphenyl)-3-fluoro-2-hydrazinylpyridine-4-carboxamide?
The canonical SMILES for N-(2,5-difluoro-4-methylphenyl)-3-fluoro-2-hydrazinylpyridine-4-carboxamide is Cc1cc(F)c(NC(=O)c2ccnc(NN)c2F)cc1F.
What is the InChIKey of N-(2,5-difluoro-4-methylphenyl)-3-fluoro-2-hydrazinylpyridine-4-carboxamide?
The InChIKey is BLVSONGNUQYMDX-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H11F3N4O/c1-6-4-9(15)10(5-8(6)14)19-13(21)7-2-3-18-12(20-17)11(7)16/h2-5H,17H2,1H3,(H,18,20)(H,19,21).
What are the key properties of N-(2,5-difluoro-4-methylphenyl)-3-fluoro-2-hydrazinylpyridine-4-carboxamide?
N-(2,5-difluoro-4-methylphenyl)-3-fluoro-2-hydrazinylpyridine-4-carboxamide has a molecular weight of 296.25 g/mol, XLogP of 2.35, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,5-difluoro-4-methylphenyl)-3-fluoro-2-hydrazinylpyridine-4-carboxamide is sourced from PubChem (CID 103587401), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).