N-(2-fluoro-5-methylphenyl)-2-hydrazinylbenzamide

C14H14FN3O — CID 62243099

IUPACN-(2-fluoro-5-methylphenyl)-2-hydrazinylbenzamide
SMILESCc1ccc(F)c(NC(=O)c2ccccc2NN)c1
InChIInChI=1S/C14H14FN3O/c1-9-6-7-11(15)13(8-9)17-14(19)10-4-2-3-5-12(10)18-16/h2-8,18H,16H2,1H3,(H,17,19)
InChIKeyBTASVXOPWWKBCU-UHFFFAOYSA-N
MW259.28 g/mol
LogP2.67
Rot. Bonds3

About N-(2-fluoro-5-methylphenyl)-2-hydrazinylbenzamide

N-(2-fluoro-5-methylphenyl)-2-hydrazinylbenzamide (PubChem CID 62243099) has the molecular formula C14H14FN3O and a molecular weight of 259.28 g/mol. Its IUPAC name is N-(2-fluoro-5-methylphenyl)-2-hydrazinylbenzamide.

Molecular Properties

Compound NameN-(2-fluoro-5-methylphenyl)-2-hydrazinylbenzamide
PubChem CID62243099
Molecular FormulaC14H14FN3O
Molecular Weight259.28 g/mol
Exact Mass259.11
IUPAC NameN-(2-fluoro-5-methylphenyl)-2-hydrazinylbenzamide
SMILESCc1ccc(F)c(NC(=O)c2ccccc2NN)c1
InChIInChI=1S/C14H14FN3O/c1-9-6-7-11(15)13(8-9)17-14(19)10-4-2-3-5-12(10)18-16/h2-8,18H,16H2,1H3,(H,17,19)
InChIKeyBTASVXOPWWKBCU-UHFFFAOYSA-N
XLogP2.67
TPSA67.15 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.28
LogP ≤ 52.67
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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-bromo-5-methylphenyl)-2-hydrazinylbenzamide
CID 82758478
N-(5-bromo-2-fluorophenyl)-2-hydrazinyl-5-methylbenzamide
CID 62513483
2-amino-3-chloro-N-(2-fluoro-5-methylphenyl)benzamide
CID 115540011
N-(2,3-difluorophenyl)-2-hydrazinyl-5-methylbenzamide
CID 62509085
2-fluoro-N-[2-(N'-hydroxycarbamimidoyl)phenyl]-5-methylbenzamide
CID 76945644
2-bromo-N-(2-fluoro-5-methylphenyl)pyridine-3-carboxamide
CID 103752054
4-fluoro-N-(2-fluoro-5-methylphenyl)-2-methylbenzamide
CID 112702327
2-hydrazinyl-N-(2-iodophenyl)-5-methylbenzamide
CID 62512985
2-chloro-N-(2-fluorophenyl)-5-methylbenzamide
CID 122630269
N-(2-fluoro-5-methylphenyl)-4-methylbenzamide
CID 7718843
5-bromo-N-(2-fluoro-5-methylphenyl)-2-hydrazinylpyridine-3-carboxamide
CID 62242736
2-hydrazinyl-N-(2,4,6-trimethylphenyl)benzamide
CID 62235197

Frequently Asked Questions

What is the IUPAC name of N-(2-fluoro-5-methylphenyl)-2-hydrazinylbenzamide?
The IUPAC name of N-(2-fluoro-5-methylphenyl)-2-hydrazinylbenzamide (CID 62243099) is N-(2-fluoro-5-methylphenyl)-2-hydrazinylbenzamide.
What is the SMILES notation for N-(2-fluoro-5-methylphenyl)-2-hydrazinylbenzamide?
The canonical SMILES for N-(2-fluoro-5-methylphenyl)-2-hydrazinylbenzamide is Cc1ccc(F)c(NC(=O)c2ccccc2NN)c1.
What is the InChIKey of N-(2-fluoro-5-methylphenyl)-2-hydrazinylbenzamide?
The InChIKey is BTASVXOPWWKBCU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14FN3O/c1-9-6-7-11(15)13(8-9)17-14(19)10-4-2-3-5-12(10)18-16/h2-8,18H,16H2,1H3,(H,17,19).
What are the key properties of N-(2-fluoro-5-methylphenyl)-2-hydrazinylbenzamide?
N-(2-fluoro-5-methylphenyl)-2-hydrazinylbenzamide has a molecular weight of 259.28 g/mol, XLogP of 2.67, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-fluoro-5-methylphenyl)-2-hydrazinylbenzamide is sourced from PubChem (CID 62243099), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).