N-(4-fluoro-2-methylphenyl)-5-hydrazinylpyridine-2-carboxamide

C13H13FN4O — CID 104642384

IUPACN-(4-fluoro-2-methylphenyl)-5-hydrazinylpyridine-2-carboxamide
SMILESCc1cc(F)ccc1NC(=O)c1ccc(NN)cn1
InChIInChI=1S/C13H13FN4O/c1-8-6-9(14)2-4-11(8)17-13(19)12-5-3-10(18-15)7-16-12/h2-7,18H,15H2,1H3,(H,17,19)
InChIKeyLSXJKALLOZRPAN-UHFFFAOYSA-N
MW260.27 g/mol
LogP2.07
Rot. Bonds3

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

N-(4-fluoro-2-methylphenyl)-5-hydrazinylpyridine-2-carboxamide (PubChem CID 104642384) has the molecular formula C13H13FN4O and a molecular weight of 260.27 g/mol. Its IUPAC name is N-(4-fluoro-2-methylphenyl)-5-hydrazinylpyridine-2-carboxamide.

Molecular Properties

Compound NameN-(4-fluoro-2-methylphenyl)-5-hydrazinylpyridine-2-carboxamide
PubChem CID104642384
Molecular FormulaC13H13FN4O
Molecular Weight260.27 g/mol
Exact Mass260.11
IUPAC NameN-(4-fluoro-2-methylphenyl)-5-hydrazinylpyridine-2-carboxamide
SMILESCc1cc(F)ccc1NC(=O)c1ccc(NN)cn1
InChIInChI=1S/C13H13FN4O/c1-8-6-9(14)2-4-11(8)17-13(19)12-5-3-10(18-15)7-16-12/h2-7,18H,15H2,1H3,(H,17,19)
InChIKeyLSXJKALLOZRPAN-UHFFFAOYSA-N
XLogP2.07
TPSA80.04 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.27
LogP ≤ 52.07
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-(4-bromo-2-fluorophenyl)-5-hydrazinylpyridine-2-carboxamide
CID 104642173
N-(4-fluoro-2-methylphenyl)-5-(methylamino)pyrazine-2-carboxamide
CID 107374291
N-(2,4-difluorophenyl)-5-(2,4-dimethylanilino)pyridine-2-carboxamide
CID 109198012
3-fluoro-N-(4-fluoro-2-methylphenyl)-2-hydrazinylpyridine-4-carboxamide
CID 105387986
N-(2,6-dichloro-4-fluorophenyl)-5-hydrazinylpyridine-2-carboxamide
CID 104643020
N-(2-bromo-3-methylphenyl)-5-hydrazinylpyridine-2-carboxamide
CID 113436381
N-(3-fluoro-4-pyridinyl)-5-hydrazinylpyridine-2-carboxamide
CID 107595556
N-(2,4-dimethylphenyl)-5-(ethylamino)pyridine-2-carboxamide
CID 104639949
5-(4-fluoroanilino)-N-(2-methylphenyl)pyridine-2-carboxamide
CID 109197166
N-(4-amino-5-chloro-2-methylphenyl)-5-fluoropyridine-2-carboxamide
CID 104667498
N-(4-fluoro-2-methylphenyl)-6-oxo-1H-pyridazine-3-carboxamide
CID 31456332
6-amino-5-chloro-N-(4-fluoro-2-methylphenyl)pyridine-3-carboxamide
CID 62156604

Frequently Asked Questions

What is the IUPAC name of N-(4-fluoro-2-methylphenyl)-5-hydrazinylpyridine-2-carboxamide?
The IUPAC name of N-(4-fluoro-2-methylphenyl)-5-hydrazinylpyridine-2-carboxamide (CID 104642384) is N-(4-fluoro-2-methylphenyl)-5-hydrazinylpyridine-2-carboxamide.
What is the SMILES notation for N-(4-fluoro-2-methylphenyl)-5-hydrazinylpyridine-2-carboxamide?
The canonical SMILES for N-(4-fluoro-2-methylphenyl)-5-hydrazinylpyridine-2-carboxamide is Cc1cc(F)ccc1NC(=O)c1ccc(NN)cn1.
What is the InChIKey of N-(4-fluoro-2-methylphenyl)-5-hydrazinylpyridine-2-carboxamide?
The InChIKey is LSXJKALLOZRPAN-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H13FN4O/c1-8-6-9(14)2-4-11(8)17-13(19)12-5-3-10(18-15)7-16-12/h2-7,18H,15H2,1H3,(H,17,19).
What are the key properties of N-(4-fluoro-2-methylphenyl)-5-hydrazinylpyridine-2-carboxamide?
N-(4-fluoro-2-methylphenyl)-5-hydrazinylpyridine-2-carboxamide has a molecular weight of 260.27 g/mol, XLogP of 2.07, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-fluoro-2-methylphenyl)-5-hydrazinylpyridine-2-carboxamide is sourced from PubChem (CID 104642384), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).