N'-[2-(2-chloro-6-fluorophenyl)acetyl]-4-fluorobenzohydrazide

C15H11ClF2N2O2 — CID 8713670

IUPACN'-[2-(2-chloro-6-fluorophenyl)acetyl]-4-fluorobenzohydrazide
SMILESO=C(Cc1c(F)cccc1Cl)NNC(=O)c1ccc(F)cc1
InChIInChI=1S/C15H11ClF2N2O2/c16-12-2-1-3-13(18)11(12)8-14(21)19-20-15(22)9-4-6-10(17)7-5-9/h1-7H,8H2,(H,19,21)(H,20,22)
InChIKeyNRLMILCGUDODQX-UHFFFAOYSA-N
MW324.71 g/mol
LogP2.62
Rot. Bonds3

About N'-[2-(2-chloro-6-fluorophenyl)acetyl]-4-fluorobenzohydrazide

N'-[2-(2-chloro-6-fluorophenyl)acetyl]-4-fluorobenzohydrazide (PubChem CID 8713670) has the molecular formula C15H11ClF2N2O2 and a molecular weight of 324.71 g/mol. Its IUPAC name is N'-[2-(2-chloro-6-fluorophenyl)acetyl]-4-fluorobenzohydrazide.

Molecular Properties

Compound NameN'-[2-(2-chloro-6-fluorophenyl)acetyl]-4-fluorobenzohydrazide
PubChem CID8713670
Molecular FormulaC15H11ClF2N2O2
Molecular Weight324.71 g/mol
Exact Mass324.05
IUPAC NameN'-[2-(2-chloro-6-fluorophenyl)acetyl]-4-fluorobenzohydrazide
SMILESO=C(Cc1c(F)cccc1Cl)NNC(=O)c1ccc(F)cc1
InChIInChI=1S/C15H11ClF2N2O2/c16-12-2-1-3-13(18)11(12)8-14(21)19-20-15(22)9-4-6-10(17)7-5-9/h1-7H,8H2,(H,19,21)(H,20,22)
InChIKeyNRLMILCGUDODQX-UHFFFAOYSA-N
XLogP2.62
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.71
LogP ≤ 52.62
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-(2-chloro-6-fluorophenyl)acetyl]benzohydrazide
CID 4811592
N'-[2-(2-chloro-6-fluorophenyl)acetyl]-4-ethylbenzohydrazide
CID 8879631
N'-acetyl-2-(2-chloro-6-fluorophenyl)acetohydrazide
CID 30905798
N'-[2-(2,6-dichlorophenoxy)acetyl]-4-fluorobenzohydrazide
CID 24684710
N'-[2-(2-chloro-6-fluorophenyl)acetyl]-2-(4-fluorophenoxy)propanehydrazide
CID 4820851
1-[[2-(2-chloro-6-fluorophenyl)acetyl]amino]-3-ethylthiourea
CID 7964165
N-(2-chloro-4-fluorophenyl)-2-(2-chloro-6-fluorophenyl)acetamide
CID 7959366
N'-[2-[(2-chlorophenyl)methylsulfanyl]acetyl]-4-fluorobenzohydrazide
CID 9037919
2-(2-chloro-6-fluorophenyl)-N-(4-hydroxyphenyl)acetamide
CID 28831544
4-chloro-N-[3-[2-(4-fluorobenzoyl)hydrazinyl]-3-oxopropyl]benzamide
CID 4795367
2-chloro-N'-[2-(2,6-dichlorophenyl)acetyl]benzohydrazide
CID 35929309
N-(2-chlorophenyl)-4-[2-(4-fluorobenzoyl)hydrazinyl]-4-oxobutanamide
CID 5229522

Frequently Asked Questions

What is the IUPAC name of N'-[2-(2-chloro-6-fluorophenyl)acetyl]-4-fluorobenzohydrazide?
The IUPAC name of N'-[2-(2-chloro-6-fluorophenyl)acetyl]-4-fluorobenzohydrazide (CID 8713670) is N'-[2-(2-chloro-6-fluorophenyl)acetyl]-4-fluorobenzohydrazide.
What is the SMILES notation for N'-[2-(2-chloro-6-fluorophenyl)acetyl]-4-fluorobenzohydrazide?
The canonical SMILES for N'-[2-(2-chloro-6-fluorophenyl)acetyl]-4-fluorobenzohydrazide is O=C(Cc1c(F)cccc1Cl)NNC(=O)c1ccc(F)cc1.
What is the InChIKey of N'-[2-(2-chloro-6-fluorophenyl)acetyl]-4-fluorobenzohydrazide?
The InChIKey is NRLMILCGUDODQX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11ClF2N2O2/c16-12-2-1-3-13(18)11(12)8-14(21)19-20-15(22)9-4-6-10(17)7-5-9/h1-7H,8H2,(H,19,21)(H,20,22).
What are the key properties of N'-[2-(2-chloro-6-fluorophenyl)acetyl]-4-fluorobenzohydrazide?
N'-[2-(2-chloro-6-fluorophenyl)acetyl]-4-fluorobenzohydrazide has a molecular weight of 324.71 g/mol, XLogP of 2.62, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N'-[2-(2-chloro-6-fluorophenyl)acetyl]-4-fluorobenzohydrazide is sourced from PubChem (CID 8713670), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).