1-[[4-methoxy-3-methyl-5-(trifluoromethyl)phenyl]methyl]-2-phenylhydrazine

C16H17F3N2O — CID 169387097

IUPAC1-[[4-methoxy-3-methyl-5-(trifluoromethyl)phenyl]methyl]-2-phenylhydrazine
SMILESCOc1c(C)cc(CNNc2ccccc2)cc1C(F)(F)F
InChIInChI=1S/C16H17F3N2O/c1-11-8-12(9-14(15(11)22-2)16(17,18)19)10-20-21-13-6-4-3-5-7-13/h3-9,20-21H,10H2,1-2H3
InChIKeyFSLSVNSNOYZZJY-UHFFFAOYSA-N
MW310.32 g/mol
LogP4.14
Rot. Bonds5

About 1-[[4-methoxy-3-methyl-5-(trifluoromethyl)phenyl]methyl]-2-phenylhydrazine

1-[[4-methoxy-3-methyl-5-(trifluoromethyl)phenyl]methyl]-2-phenylhydrazine (PubChem CID 169387097) has the molecular formula C16H17F3N2O and a molecular weight of 310.32 g/mol. Its IUPAC name is 1-[[4-methoxy-3-methyl-5-(trifluoromethyl)phenyl]methyl]-2-phenylhydrazine.

Molecular Properties

Compound Name1-[[4-methoxy-3-methyl-5-(trifluoromethyl)phenyl]methyl]-2-phenylhydrazine
PubChem CID169387097
Molecular FormulaC16H17F3N2O
Molecular Weight310.32 g/mol
Exact Mass310.13
IUPAC Name1-[[4-methoxy-3-methyl-5-(trifluoromethyl)phenyl]methyl]-2-phenylhydrazine
SMILESCOc1c(C)cc(CNNc2ccccc2)cc1C(F)(F)F
InChIInChI=1S/C16H17F3N2O/c1-11-8-12(9-14(15(11)22-2)16(17,18)19)10-20-21-13-6-4-3-5-7-13/h3-9,20-21H,10H2,1-2H3
InChIKeyFSLSVNSNOYZZJY-UHFFFAOYSA-N
XLogP4.14
TPSA33.29 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.32
LogP ≤ 54.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze 1-[[4-methoxy-3-methyl-5-(trifluoromethyl)phenyl]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-[[4-fluoro-3-methyl-5-(trifluoromethyl)phenyl]methyl]-2-phenylhydrazine
CID 169385923
4-methoxy-3,5-dimethyl-2-[(2-phenylhydrazinyl)methyl]phenol
CID 169385232
1-[(3,4-dimethoxy-5-phenylmethoxyphenyl)methyl]-2-phenylhydrazine
CID 169386843
[2-methyl-4-[(2-phenylhydrazinyl)methyl]phenyl]boronic acid
CID 169384701
1-[(3-bromo-2-methoxy-6-methylphenyl)methyl]-2-phenylhydrazine
CID 169387140
1-[[4-[4-fluoro-3-(trifluoromethyl)phenyl]phenyl]methyl]-2-phenylhydrazine
CID 169385350
2-methoxy-3-nitro-5-[(2-phenylhydrazinyl)methyl]phenol
CID 169386673
2-[2,6-dimethoxy-4-[(2-phenylhydrazinyl)methyl]phenoxy]acetic acid
CID 169385803
1-[(3,5-difluoro-4-propoxyphenyl)methyl]-2-phenylhydrazine
CID 169384890
1-[(4,6-dichloro-2-fluoro-3-methoxyphenyl)methyl]-2-phenylhydrazine
CID 169386720
1-[[4-iodo-2-(trifluoromethyl)phenyl]methyl]-2-phenylhydrazine
CID 169386753
1-[[4-methoxy-3-[[3-(trifluoromethyl)phenyl]methoxy]phenyl]methyl]-2-phenylhydrazine
CID 169386023

Frequently Asked Questions

What is the IUPAC name of 1-[[4-methoxy-3-methyl-5-(trifluoromethyl)phenyl]methyl]-2-phenylhydrazine?
The IUPAC name of 1-[[4-methoxy-3-methyl-5-(trifluoromethyl)phenyl]methyl]-2-phenylhydrazine (CID 169387097) is 1-[[4-methoxy-3-methyl-5-(trifluoromethyl)phenyl]methyl]-2-phenylhydrazine.
What is the SMILES notation for 1-[[4-methoxy-3-methyl-5-(trifluoromethyl)phenyl]methyl]-2-phenylhydrazine?
The canonical SMILES for 1-[[4-methoxy-3-methyl-5-(trifluoromethyl)phenyl]methyl]-2-phenylhydrazine is COc1c(C)cc(CNNc2ccccc2)cc1C(F)(F)F.
What is the InChIKey of 1-[[4-methoxy-3-methyl-5-(trifluoromethyl)phenyl]methyl]-2-phenylhydrazine?
The InChIKey is FSLSVNSNOYZZJY-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17F3N2O/c1-11-8-12(9-14(15(11)22-2)16(17,18)19)10-20-21-13-6-4-3-5-7-13/h3-9,20-21H,10H2,1-2H3.
What are the key properties of 1-[[4-methoxy-3-methyl-5-(trifluoromethyl)phenyl]methyl]-2-phenylhydrazine?
1-[[4-methoxy-3-methyl-5-(trifluoromethyl)phenyl]methyl]-2-phenylhydrazine has a molecular weight of 310.32 g/mol, XLogP of 4.14, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[[4-methoxy-3-methyl-5-(trifluoromethyl)phenyl]methyl]-2-phenylhydrazine is sourced from PubChem (CID 169387097), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).