3-[(4-fluorophenyl)-hydrazinylmethyl]-N,N-dimethylaniline

C15H18FN3 — CID 105284037

IUPAC3-[(4-fluorophenyl)-hydrazinylmethyl]-N,N-dimethylaniline
SMILESCN(C)c1cccc(C(NN)c2ccc(F)cc2)c1
InChIInChI=1S/C15H18FN3/c1-19(2)14-5-3-4-12(10-14)15(18-17)11-6-8-13(16)9-7-11/h3-10,15,18H,17H2,1-2H3
InChIKeyHFPCGGSCHYXOKO-UHFFFAOYSA-N
MW259.33 g/mol
LogP2.44
Rot. Bonds4

About 3-[(4-fluorophenyl)-hydrazinylmethyl]-N,N-dimethylaniline

3-[(4-fluorophenyl)-hydrazinylmethyl]-N,N-dimethylaniline (PubChem CID 105284037) has the molecular formula C15H18FN3 and a molecular weight of 259.33 g/mol. Its IUPAC name is 3-[(4-fluorophenyl)-hydrazinylmethyl]-N,N-dimethylaniline.

Molecular Properties

Compound Name3-[(4-fluorophenyl)-hydrazinylmethyl]-N,N-dimethylaniline
PubChem CID105284037
Molecular FormulaC15H18FN3
Molecular Weight259.33 g/mol
Exact Mass259.15
IUPAC Name3-[(4-fluorophenyl)-hydrazinylmethyl]-N,N-dimethylaniline
SMILESCN(C)c1cccc(C(NN)c2ccc(F)cc2)c1
InChIInChI=1S/C15H18FN3/c1-19(2)14-5-3-4-12(10-14)15(18-17)11-6-8-13(16)9-7-11/h3-10,15,18H,17H2,1-2H3
InChIKeyHFPCGGSCHYXOKO-UHFFFAOYSA-N
XLogP2.44
TPSA41.29 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.33
LogP ≤ 52.44
H-Bond Donors ≤ 52
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

3-[hydrazinyl(phenyl)methyl]-N,N-dimethylaniline
CID 105282900
3-[(3-ethylphenyl)-hydrazinylmethyl]-N,N-dimethylaniline
CID 105326250
3-[furan-2-yl(hydrazinyl)methyl]-N,N-dimethylaniline
CID 105305991
[(4-fluorophenyl)-[3-(trifluoromethyl)phenyl]methyl]hydrazine
CID 105192836
3-[hydrazinyl-(1-methylpyrazol-4-yl)methyl]-N,N-dimethylaniline
CID 105288676
[(3,5-difluorophenyl)-(4-fluorophenyl)methyl]hydrazine
CID 105192791
4-[(3-fluorophenyl)-(methylamino)methyl]-N,N-dimethylaniline
CID 105092995
3-[amino-(3,5-difluorophenyl)methyl]-N,N-dimethylaniline
CID 105141994
[(3,4-dimethylphenyl)-(3-fluorophenyl)methyl]hydrazine
CID 105193094
3-[ethylamino-(4-methylphenyl)methyl]-N,N-dimethylaniline
CID 105092548
[(4-fluorophenyl)-(4-methylsulfanylphenyl)methyl]hydrazine
CID 105284116
4-[(4-fluorophenyl)-(methylamino)methyl]-N,N-dimethylaniline
CID 105088233

Frequently Asked Questions

What is the IUPAC name of 3-[(4-fluorophenyl)-hydrazinylmethyl]-N,N-dimethylaniline?
The IUPAC name of 3-[(4-fluorophenyl)-hydrazinylmethyl]-N,N-dimethylaniline (CID 105284037) is 3-[(4-fluorophenyl)-hydrazinylmethyl]-N,N-dimethylaniline.
What is the SMILES notation for 3-[(4-fluorophenyl)-hydrazinylmethyl]-N,N-dimethylaniline?
The canonical SMILES for 3-[(4-fluorophenyl)-hydrazinylmethyl]-N,N-dimethylaniline is CN(C)c1cccc(C(NN)c2ccc(F)cc2)c1.
What is the InChIKey of 3-[(4-fluorophenyl)-hydrazinylmethyl]-N,N-dimethylaniline?
The InChIKey is HFPCGGSCHYXOKO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18FN3/c1-19(2)14-5-3-4-12(10-14)15(18-17)11-6-8-13(16)9-7-11/h3-10,15,18H,17H2,1-2H3.
What are the key properties of 3-[(4-fluorophenyl)-hydrazinylmethyl]-N,N-dimethylaniline?
3-[(4-fluorophenyl)-hydrazinylmethyl]-N,N-dimethylaniline has a molecular weight of 259.33 g/mol, XLogP of 2.44, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(4-fluorophenyl)-hydrazinylmethyl]-N,N-dimethylaniline is sourced from PubChem (CID 105284037), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).