4-(4-methoxyphenyl)-1-[(4-methoxyphenyl)methyl]triazole

C17H17N3O2 — CID 57402494

IUPAC4-(4-methoxyphenyl)-1-[(4-methoxyphenyl)methyl]triazole
SMILESCOc1ccc(Cn2cc(-c3ccc(OC)cc3)nn2)cc1
InChIInChI=1S/C17H17N3O2/c1-21-15-7-3-13(4-8-15)11-20-12-17(18-19-20)14-5-9-16(22-2)10-6-14/h3-10,12H,11H2,1-2H3
InChIKeyUHZHNPNPAYGNGZ-UHFFFAOYSA-N
MW295.34 g/mol
LogP3.01
Rot. Bonds5

About 4-(4-methoxyphenyl)-1-[(4-methoxyphenyl)methyl]triazole

4-(4-methoxyphenyl)-1-[(4-methoxyphenyl)methyl]triazole (PubChem CID 57402494) has the molecular formula C17H17N3O2 and a molecular weight of 295.34 g/mol. Its IUPAC name is 4-(4-methoxyphenyl)-1-[(4-methoxyphenyl)methyl]triazole.

Molecular Properties

Compound Name4-(4-methoxyphenyl)-1-[(4-methoxyphenyl)methyl]triazole
PubChem CID57402494
Molecular FormulaC17H17N3O2
Molecular Weight295.34 g/mol
Exact Mass295.13
IUPAC Name4-(4-methoxyphenyl)-1-[(4-methoxyphenyl)methyl]triazole
SMILESCOc1ccc(Cn2cc(-c3ccc(OC)cc3)nn2)cc1
InChIInChI=1S/C17H17N3O2/c1-21-15-7-3-13(4-8-15)11-20-12-17(18-19-20)14-5-9-16(22-2)10-6-14/h3-10,12H,11H2,1-2H3
InChIKeyUHZHNPNPAYGNGZ-UHFFFAOYSA-N
XLogP3.01
TPSA49.17 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.34
LogP ≤ 53.01
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze 4-(4-methoxyphenyl)-1-[(4-methoxyphenyl)methyl]triazole 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

3-(4-methoxyphenyl)-1-phenyl-1H-pyrazole-4-carbaldehyde oxime
CID 6894322
1-Benzyl-4-(4-methoxyphenyl)-1h-imidazole
CID 6539910
2-Methoxy-5-[4-[[4-(4-methylphenyl)triazol-1-yl]methyl]phenyl]pyridine
CID 155520839
3-[1-(4-Carbamimidoylphenyl)triazol-4-yl]-4-methoxybenzenecarboximidamide
CID 44627437
3-[4-(4-Fluoro-phenoxy)-phenyl]-1-methyl-1H-pyrazole
CID 11242617
2-(4-Butoxy-phenyl)-pyrazine
CID 11345209
4-[1-[4-[2-[2-(2-fluoroethoxy)ethoxy]ethoxy]phenyl]triazol-4-yl]-N,N-dimethylaniline
CID 16736235
3-[4-[4-[4-(Dimethylamino)phenyl]triazol-1-yl]phenoxy]propan-1-ol
CID 16736236
4-[1-[4-(3-fluoropropoxy)phenyl]triazol-4-yl]-N,N-dimethylaniline
CID 16736237
4-[1-[4-(2-fluoroethoxy)phenyl]triazol-4-yl]-N,N-dimethylaniline
CID 16736456
N-hydroxy-7-[4-(4-methoxyphenyl)triazol-1-yl]heptanamide
CID 25068485
4-(1-(2,3-dimethoxybenzyl)-1H-1,2,3-triazol-4-yl)phenol
CID 50908752

Frequently Asked Questions

What is the IUPAC name of 4-(4-methoxyphenyl)-1-[(4-methoxyphenyl)methyl]triazole?
The IUPAC name of 4-(4-methoxyphenyl)-1-[(4-methoxyphenyl)methyl]triazole (CID 57402494) is 4-(4-methoxyphenyl)-1-[(4-methoxyphenyl)methyl]triazole.
What is the SMILES notation for 4-(4-methoxyphenyl)-1-[(4-methoxyphenyl)methyl]triazole?
The canonical SMILES for 4-(4-methoxyphenyl)-1-[(4-methoxyphenyl)methyl]triazole is COc1ccc(Cn2cc(-c3ccc(OC)cc3)nn2)cc1.
What is the InChIKey of 4-(4-methoxyphenyl)-1-[(4-methoxyphenyl)methyl]triazole?
The InChIKey is UHZHNPNPAYGNGZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17N3O2/c1-21-15-7-3-13(4-8-15)11-20-12-17(18-19-20)14-5-9-16(22-2)10-6-14/h3-10,12H,11H2,1-2H3.
What are the key properties of 4-(4-methoxyphenyl)-1-[(4-methoxyphenyl)methyl]triazole?
4-(4-methoxyphenyl)-1-[(4-methoxyphenyl)methyl]triazole has a molecular weight of 295.34 g/mol, XLogP of 3.01, 5 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-methoxyphenyl)-1-[(4-methoxyphenyl)methyl]triazole is sourced from PubChem (CID 57402494), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).