N'-acetyl-4-fluoro-2-methylbenzohydrazide

C10H11FN2O2 — CID 115745372

IUPACN'-acetyl-4-fluoro-2-methylbenzohydrazide
SMILESCC(=O)NNC(=O)c1ccc(F)cc1C
InChIInChI=1S/C10H11FN2O2/c1-6-5-8(11)3-4-9(6)10(15)13-12-7(2)14/h3-5H,1-2H3,(H,12,14)(H,13,15)
InChIKeyHDRBKRCNCUZETP-UHFFFAOYSA-N
MW210.21 g/mol
LogP0.92
Rot. Bonds1

About N'-acetyl-4-fluoro-2-methylbenzohydrazide

N'-acetyl-4-fluoro-2-methylbenzohydrazide (PubChem CID 115745372) has the molecular formula C10H11FN2O2 and a molecular weight of 210.21 g/mol. Its IUPAC name is N'-acetyl-4-fluoro-2-methylbenzohydrazide.

Molecular Properties

Compound NameN'-acetyl-4-fluoro-2-methylbenzohydrazide
PubChem CID115745372
Molecular FormulaC10H11FN2O2
Molecular Weight210.21 g/mol
Exact Mass210.08
IUPAC NameN'-acetyl-4-fluoro-2-methylbenzohydrazide
SMILESCC(=O)NNC(=O)c1ccc(F)cc1C
InChIInChI=1S/C10H11FN2O2/c1-6-5-8(11)3-4-9(6)10(15)13-12-7(2)14/h3-5H,1-2H3,(H,12,14)(H,13,15)
InChIKeyHDRBKRCNCUZETP-UHFFFAOYSA-N
XLogP0.92
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.21
LogP ≤ 50.92
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

N'-(2,5-difluorobenzoyl)-2,4-dimethylbenzohydrazide
CID 24644754
1-(4-fluoro-2-methylphenyl)ethanone
CID 3494772
N'-(2-bromo-4-fluorobenzoyl)-2,4-dimethylbenzohydrazide
CID 9276694
N-[1,3-dihydroxy-2-(hydroxymethyl)propan-2-yl]-4-fluoro-2-methylbenzamide
CID 114008483
N-[3-(chloromethyl)pentan-3-yl]-4-fluoro-2-methylbenzamide
CID 113400388
1-(4-fluoro-2-methylphenyl)butane-1,3-dione
CID 55262326
4-fluoro-2-methyl-N-(3,4,5-trifluorophenyl)benzamide
CID 115745629
4-fluoro-2-methyl-N-(2-methylpropoxy)benzamide
CID 112703509
azetidin-1-yl-(4-fluoro-2-methylphenyl)methanone
CID 130163592
N-(2-carbamoylphenyl)-4-fluoro-2-methylbenzamide
CID 115745249
4-fluoro-2-methyl-N-pyrimidin-2-ylbenzamide
CID 115745693
N-(2-bromo-4-fluorophenyl)-4-fluoro-2-methylbenzamide
CID 112702520

Frequently Asked Questions

What is the IUPAC name of N'-acetyl-4-fluoro-2-methylbenzohydrazide?
The IUPAC name of N'-acetyl-4-fluoro-2-methylbenzohydrazide (CID 115745372) is N'-acetyl-4-fluoro-2-methylbenzohydrazide.
What is the SMILES notation for N'-acetyl-4-fluoro-2-methylbenzohydrazide?
The canonical SMILES for N'-acetyl-4-fluoro-2-methylbenzohydrazide is CC(=O)NNC(=O)c1ccc(F)cc1C.
What is the InChIKey of N'-acetyl-4-fluoro-2-methylbenzohydrazide?
The InChIKey is HDRBKRCNCUZETP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11FN2O2/c1-6-5-8(11)3-4-9(6)10(15)13-12-7(2)14/h3-5H,1-2H3,(H,12,14)(H,13,15).
What are the key properties of N'-acetyl-4-fluoro-2-methylbenzohydrazide?
N'-acetyl-4-fluoro-2-methylbenzohydrazide has a molecular weight of 210.21 g/mol, XLogP of 0.92, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N'-acetyl-4-fluoro-2-methylbenzohydrazide is sourced from PubChem (CID 115745372), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).