N-(3-fluoro-4-methylphenyl)-3-hydrazinylpyridine-4-carboxamide

C13H13FN4O — CID 105071773

IUPACN-(3-fluoro-4-methylphenyl)-3-hydrazinylpyridine-4-carboxamide
SMILESCc1ccc(NC(=O)c2ccncc2NN)cc1F
InChIInChI=1S/C13H13FN4O/c1-8-2-3-9(6-11(8)14)17-13(19)10-4-5-16-7-12(10)18-15/h2-7,18H,15H2,1H3,(H,17,19)
InChIKeyDITBIJZRSWRCKN-UHFFFAOYSA-N
MW260.27 g/mol
LogP2.07
Rot. Bonds3

About N-(3-fluoro-4-methylphenyl)-3-hydrazinylpyridine-4-carboxamide

N-(3-fluoro-4-methylphenyl)-3-hydrazinylpyridine-4-carboxamide (PubChem CID 105071773) has the molecular formula C13H13FN4O and a molecular weight of 260.27 g/mol. Its IUPAC name is N-(3-fluoro-4-methylphenyl)-3-hydrazinylpyridine-4-carboxamide.

Molecular Properties

Compound NameN-(3-fluoro-4-methylphenyl)-3-hydrazinylpyridine-4-carboxamide
PubChem CID105071773
Molecular FormulaC13H13FN4O
Molecular Weight260.27 g/mol
Exact Mass260.11
IUPAC NameN-(3-fluoro-4-methylphenyl)-3-hydrazinylpyridine-4-carboxamide
SMILESCc1ccc(NC(=O)c2ccncc2NN)cc1F
InChIInChI=1S/C13H13FN4O/c1-8-2-3-9(6-11(8)14)17-13(19)10-4-5-16-7-12(10)18-15/h2-7,18H,15H2,1H3,(H,17,19)
InChIKeyDITBIJZRSWRCKN-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

3-hydrazinyl-N-pyridin-4-ylpyridine-4-carboxamide
CID 105071908
N-(3-fluoro-4-pyridinyl)-3-hydrazinylpyridine-4-carboxamide
CID 107595570
N-(3,4-difluorophenyl)-3-(methylamino)pyridine-4-carboxamide
CID 105068229
N-(3-amino-4-methylphenyl)-3-fluoropyridine-4-carboxamide
CID 64950847
N-[(4-fluoro-3,5-dimethylphenyl)methyl]-3-hydrazinylpyridine-4-carboxamide
CID 105072340
N-(4-chloro-3-fluorophenyl)-3-(methylamino)pyridine-4-carboxamide
CID 105069465
N-(4-fluorophenyl)-3-methylpyridine-4-carboxamide
CID 110858696
3-hydrazinyl-N-[3-(trifluoromethyl)phenyl]pyridine-4-carboxamide
CID 105071549
3-hydrazinyl-N-(3-propan-2-ylphenyl)pyridine-4-carboxamide
CID 105071923
N-(4-ethoxyphenyl)-3-hydrazinylpyridine-4-carboxamide
CID 105071538
5-amino-N-(3-fluoro-4-methylphenyl)-2-methylpyridine-3-carboxamide
CID 54914178
5-amino-N-(3-fluoro-4-methylphenyl)-2-methylbenzamide
CID 61291909

Frequently Asked Questions

What is the IUPAC name of N-(3-fluoro-4-methylphenyl)-3-hydrazinylpyridine-4-carboxamide?
The IUPAC name of N-(3-fluoro-4-methylphenyl)-3-hydrazinylpyridine-4-carboxamide (CID 105071773) is N-(3-fluoro-4-methylphenyl)-3-hydrazinylpyridine-4-carboxamide.
What is the SMILES notation for N-(3-fluoro-4-methylphenyl)-3-hydrazinylpyridine-4-carboxamide?
The canonical SMILES for N-(3-fluoro-4-methylphenyl)-3-hydrazinylpyridine-4-carboxamide is Cc1ccc(NC(=O)c2ccncc2NN)cc1F.
What is the InChIKey of N-(3-fluoro-4-methylphenyl)-3-hydrazinylpyridine-4-carboxamide?
The InChIKey is DITBIJZRSWRCKN-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H13FN4O/c1-8-2-3-9(6-11(8)14)17-13(19)10-4-5-16-7-12(10)18-15/h2-7,18H,15H2,1H3,(H,17,19).
What are the key properties of N-(3-fluoro-4-methylphenyl)-3-hydrazinylpyridine-4-carboxamide?
N-(3-fluoro-4-methylphenyl)-3-hydrazinylpyridine-4-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-(3-fluoro-4-methylphenyl)-3-hydrazinylpyridine-4-carboxamide is sourced from PubChem (CID 105071773), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).