1-[(2,6-dichloro-3-fluorophenyl)methyl]-2-phenylhydrazine

C13H11Cl2FN2 — CID 169385518

IUPAC1-[(2,6-dichloro-3-fluorophenyl)methyl]-2-phenylhydrazine
SMILESFc1ccc(Cl)c(CNNc2ccccc2)c1Cl
InChIInChI=1S/C13H11Cl2FN2/c14-11-6-7-12(16)13(15)10(11)8-17-18-9-4-2-1-3-5-9/h1-7,17-18H,8H2
InChIKeyXZBKWDBEPPHXAP-UHFFFAOYSA-N
MW285.15 g/mol
LogP4.25
Rot. Bonds4

About 1-[(2,6-dichloro-3-fluorophenyl)methyl]-2-phenylhydrazine

1-[(2,6-dichloro-3-fluorophenyl)methyl]-2-phenylhydrazine (PubChem CID 169385518) has the molecular formula C13H11Cl2FN2 and a molecular weight of 285.15 g/mol. Its IUPAC name is 1-[(2,6-dichloro-3-fluorophenyl)methyl]-2-phenylhydrazine.

Molecular Properties

Compound Name1-[(2,6-dichloro-3-fluorophenyl)methyl]-2-phenylhydrazine
PubChem CID169385518
Molecular FormulaC13H11Cl2FN2
Molecular Weight285.15 g/mol
Exact Mass284.03
IUPAC Name1-[(2,6-dichloro-3-fluorophenyl)methyl]-2-phenylhydrazine
SMILESFc1ccc(Cl)c(CNNc2ccccc2)c1Cl
InChIInChI=1S/C13H11Cl2FN2/c14-11-6-7-12(16)13(15)10(11)8-17-18-9-4-2-1-3-5-9/h1-7,17-18H,8H2
InChIKeyXZBKWDBEPPHXAP-UHFFFAOYSA-N
XLogP4.25
TPSA24.06 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.15
LogP ≤ 54.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'halogenated_ring_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze 1-[(2,6-dichloro-3-fluorophenyl)methyl]-2-phenylhydrazine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-[[2-chloro-6-(trifluoromethyl)phenyl]methyl]-2-phenylhydrazine
CID 169384542
1-[(4-chlorophenyl)methyl]-2-phenylhydrazine
CID 70410939
2,4-difluoro-3-[(2-phenylhydrazinyl)methyl]phenol
CID 169387245
1-[(4,6-dichloro-2-fluoro-3-methoxyphenyl)methyl]-2-phenylhydrazine
CID 169386720
1-[(2-chloro-4-fluoro-5-methylphenyl)methyl]-2-phenylhydrazine
CID 169386722
1,3-dichloro-4-fluoro-2-(fluoromethyl)benzene
CID 118830415
1-[[2,3-difluoro-6-(trifluoromethoxy)phenyl]methyl]-2-phenylhydrazine
CID 169386741
1-[(2-ethynyl-6-fluorophenyl)methyl]-2-phenylhydrazine
CID 169386711
3-chloro-4-fluoro-N-[(2,3,6-trichlorophenyl)methyl]aniline
CID 43772414
1-[(2-fluoro-5-iodophenyl)methyl]-2-phenylhydrazine
CID 169384471
1-[(2,6-dibromophenyl)methyl]-2-phenylhydrazine
CID 169384469
1-[(2,3-difluorophenyl)methyl]-2-phenylhydrazine
CID 169384437

Frequently Asked Questions

What is the IUPAC name of 1-[(2,6-dichloro-3-fluorophenyl)methyl]-2-phenylhydrazine?
The IUPAC name of 1-[(2,6-dichloro-3-fluorophenyl)methyl]-2-phenylhydrazine (CID 169385518) is 1-[(2,6-dichloro-3-fluorophenyl)methyl]-2-phenylhydrazine.
What is the SMILES notation for 1-[(2,6-dichloro-3-fluorophenyl)methyl]-2-phenylhydrazine?
The canonical SMILES for 1-[(2,6-dichloro-3-fluorophenyl)methyl]-2-phenylhydrazine is Fc1ccc(Cl)c(CNNc2ccccc2)c1Cl.
What is the InChIKey of 1-[(2,6-dichloro-3-fluorophenyl)methyl]-2-phenylhydrazine?
The InChIKey is XZBKWDBEPPHXAP-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H11Cl2FN2/c14-11-6-7-12(16)13(15)10(11)8-17-18-9-4-2-1-3-5-9/h1-7,17-18H,8H2.
What are the key properties of 1-[(2,6-dichloro-3-fluorophenyl)methyl]-2-phenylhydrazine?
1-[(2,6-dichloro-3-fluorophenyl)methyl]-2-phenylhydrazine has a molecular weight of 285.15 g/mol, XLogP of 4.25, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(2,6-dichloro-3-fluorophenyl)methyl]-2-phenylhydrazine is sourced from PubChem (CID 169385518), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).