5-chloro-N-(2,3-difluorophenyl)-6-hydrazinylpyridine-3-carboxamide

C12H9ClF2N4O — CID 62236975

IUPAC5-chloro-N-(2,3-difluorophenyl)-6-hydrazinylpyridine-3-carboxamide
SMILESNNc1ncc(C(=O)Nc2cccc(F)c2F)cc1Cl
InChIInChI=1S/C12H9ClF2N4O/c13-7-4-6(5-17-11(7)19-16)12(20)18-9-3-1-2-8(14)10(9)15/h1-5H,16H2,(H,17,19)(H,18,20)
InChIKeyRAKYQLFLDDSONQ-UHFFFAOYSA-N
MW298.68 g/mol
LogP2.55
Rot. Bonds3

About 5-chloro-N-(2,3-difluorophenyl)-6-hydrazinylpyridine-3-carboxamide

5-chloro-N-(2,3-difluorophenyl)-6-hydrazinylpyridine-3-carboxamide (PubChem CID 62236975) has the molecular formula C12H9ClF2N4O and a molecular weight of 298.68 g/mol. Its IUPAC name is 5-chloro-N-(2,3-difluorophenyl)-6-hydrazinylpyridine-3-carboxamide.

Molecular Properties

Compound Name5-chloro-N-(2,3-difluorophenyl)-6-hydrazinylpyridine-3-carboxamide
PubChem CID62236975
Molecular FormulaC12H9ClF2N4O
Molecular Weight298.68 g/mol
Exact Mass298.04
IUPAC Name5-chloro-N-(2,3-difluorophenyl)-6-hydrazinylpyridine-3-carboxamide
SMILESNNc1ncc(C(=O)Nc2cccc(F)c2F)cc1Cl
InChIInChI=1S/C12H9ClF2N4O/c13-7-4-6(5-17-11(7)19-16)12(20)18-9-3-1-2-8(14)10(9)15/h1-5H,16H2,(H,17,19)(H,18,20)
InChIKeyRAKYQLFLDDSONQ-UHFFFAOYSA-N
XLogP2.55
TPSA80.04 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.68
LogP ≤ 52.55
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

5-chloro-N-(2-fluoro-5-methylphenyl)-6-hydrazinylpyridine-3-carboxamide
CID 62242553
5-chloro-N-(2,6-dibromophenyl)-6-hydrazinylpyridine-3-carboxamide
CID 107603472
5-chloro-N-(2-cyano-3-methylphenyl)-6-hydrazinylpyridine-3-carboxamide
CID 107801438
5-chloro-N-(5-fluoro-2-pyridinyl)-6-hydrazinylpyridine-3-carboxamide
CID 65481484
5-chloro-6-hydrazinyl-N-(3-methylsulfanylphenyl)pyridine-3-carboxamide
CID 62235361
2-amino-N-(2,3-difluorophenyl)pyridine-4-carboxamide
CID 62161331
5-chloro-6-hydrazinyl-N-(3-propan-2-ylphenyl)pyridine-3-carboxamide
CID 62243463
5-(aminomethyl)-N-(2,3-difluorophenyl)pyridine-2-carboxamide
CID 55229818
N-(2,3-difluorophenyl)benzamide
CID 139202270
5-chloro-N-(2,3-dimethylphenyl)-6-(methylamino)pyridine-3-carboxamide
CID 62165739
N-(2,3-difluorophenyl)pyridine-4-carboxamide
CID 47450883
5-chloro-N-(3-fluoro-4-pyridinyl)-6-(methylamino)pyridine-3-carboxamide
CID 107595440

Frequently Asked Questions

What is the IUPAC name of 5-chloro-N-(2,3-difluorophenyl)-6-hydrazinylpyridine-3-carboxamide?
The IUPAC name of 5-chloro-N-(2,3-difluorophenyl)-6-hydrazinylpyridine-3-carboxamide (CID 62236975) is 5-chloro-N-(2,3-difluorophenyl)-6-hydrazinylpyridine-3-carboxamide.
What is the SMILES notation for 5-chloro-N-(2,3-difluorophenyl)-6-hydrazinylpyridine-3-carboxamide?
The canonical SMILES for 5-chloro-N-(2,3-difluorophenyl)-6-hydrazinylpyridine-3-carboxamide is NNc1ncc(C(=O)Nc2cccc(F)c2F)cc1Cl.
What is the InChIKey of 5-chloro-N-(2,3-difluorophenyl)-6-hydrazinylpyridine-3-carboxamide?
The InChIKey is RAKYQLFLDDSONQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H9ClF2N4O/c13-7-4-6(5-17-11(7)19-16)12(20)18-9-3-1-2-8(14)10(9)15/h1-5H,16H2,(H,17,19)(H,18,20).
What are the key properties of 5-chloro-N-(2,3-difluorophenyl)-6-hydrazinylpyridine-3-carboxamide?
5-chloro-N-(2,3-difluorophenyl)-6-hydrazinylpyridine-3-carboxamide has a molecular weight of 298.68 g/mol, XLogP of 2.55, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-N-(2,3-difluorophenyl)-6-hydrazinylpyridine-3-carboxamide is sourced from PubChem (CID 62236975), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).