3-fluoro-2-hydrazinyl-N-(3-methyl-4-pyridinyl)benzamide

C13H13FN4O — CID 63671738

IUPAC3-fluoro-2-hydrazinyl-N-(3-methyl-4-pyridinyl)benzamide
SMILESCc1cnccc1NC(=O)c1cccc(F)c1NN
InChIInChI=1S/C13H13FN4O/c1-8-7-16-6-5-11(8)17-13(19)9-3-2-4-10(14)12(9)18-15/h2-7,18H,15H2,1H3,(H,16,17,19)
InChIKeyMPJOMTJYDNCHIU-UHFFFAOYSA-N
MW260.27 g/mol
LogP2.07
Rot. Bonds3

About 3-fluoro-2-hydrazinyl-N-(3-methyl-4-pyridinyl)benzamide

3-fluoro-2-hydrazinyl-N-(3-methyl-4-pyridinyl)benzamide (PubChem CID 63671738) has the molecular formula C13H13FN4O and a molecular weight of 260.27 g/mol. Its IUPAC name is 3-fluoro-2-hydrazinyl-N-(3-methyl-4-pyridinyl)benzamide.

Molecular Properties

Compound Name3-fluoro-2-hydrazinyl-N-(3-methyl-4-pyridinyl)benzamide
PubChem CID63671738
Molecular FormulaC13H13FN4O
Molecular Weight260.27 g/mol
Exact Mass260.11
IUPAC Name3-fluoro-2-hydrazinyl-N-(3-methyl-4-pyridinyl)benzamide
SMILESCc1cnccc1NC(=O)c1cccc(F)c1NN
InChIInChI=1S/C13H13FN4O/c1-8-7-16-6-5-11(8)17-13(19)9-3-2-4-10(14)12(9)18-15/h2-7,18H,15H2,1H3,(H,16,17,19)
InChIKeyMPJOMTJYDNCHIU-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

4-hydrazinyl-N-(3-methyl-4-pyridinyl)pyridine-3-carboxamide
CID 81249230
3-fluoro-2-hydrazinyl-N-pyridin-3-ylbenzamide
CID 62660800
2-amino-3-chloro-N-(3-methyl-4-pyridinyl)benzamide
CID 113331765
3-fluoro-N-(3-fluoro-4-pyridinyl)-2-(propylamino)benzamide
CID 107595462
N-(4-bromo-3,5-dimethylphenyl)-3-fluoro-2-hydrazinylbenzamide
CID 107578899
N-(2-fluoro-6-methylphenyl)-3-(methylamino)pyridine-4-carboxamide
CID 105071404
3-fluoro-N-(5-fluoro-2-pyridinyl)-2-hydrazinylbenzamide
CID 65481879
N-(2-cyano-3-fluorophenyl)-3-fluoro-2-hydrazinylbenzamide
CID 62660264
N-(3,4-dichlorophenyl)-3-fluoro-2-hydrazinylbenzamide
CID 62660094
2-bromo-3-fluoro-N-(3-fluoro-4-pyridinyl)benzamide
CID 107595178
4-hydrazinyl-N-(3-methyl-4-pyridinyl)pyridine-2-carboxamide
CID 63671568
3-fluoro-2-hydrazinyl-N-(thiadiazol-5-yl)benzamide
CID 114914426

Frequently Asked Questions

What is the IUPAC name of 3-fluoro-2-hydrazinyl-N-(3-methyl-4-pyridinyl)benzamide?
The IUPAC name of 3-fluoro-2-hydrazinyl-N-(3-methyl-4-pyridinyl)benzamide (CID 63671738) is 3-fluoro-2-hydrazinyl-N-(3-methyl-4-pyridinyl)benzamide.
What is the SMILES notation for 3-fluoro-2-hydrazinyl-N-(3-methyl-4-pyridinyl)benzamide?
The canonical SMILES for 3-fluoro-2-hydrazinyl-N-(3-methyl-4-pyridinyl)benzamide is Cc1cnccc1NC(=O)c1cccc(F)c1NN.
What is the InChIKey of 3-fluoro-2-hydrazinyl-N-(3-methyl-4-pyridinyl)benzamide?
The InChIKey is MPJOMTJYDNCHIU-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H13FN4O/c1-8-7-16-6-5-11(8)17-13(19)9-3-2-4-10(14)12(9)18-15/h2-7,18H,15H2,1H3,(H,16,17,19).
What are the key properties of 3-fluoro-2-hydrazinyl-N-(3-methyl-4-pyridinyl)benzamide?
3-fluoro-2-hydrazinyl-N-(3-methyl-4-pyridinyl)benzamide 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 3-fluoro-2-hydrazinyl-N-(3-methyl-4-pyridinyl)benzamide is sourced from PubChem (CID 63671738), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).