(4-fluorophenyl)methyl-(1,2,4-triazol-1-ylmethyl)silane

C10H12FN3Si — CID 150513747

IUPAC(4-fluorophenyl)methyl-(1,2,4-triazol-1-ylmethyl)silane
SMILESFc1ccc(C[SiH2]Cn2cncn2)cc1
InChIInChI=1S/C10H12FN3Si/c11-10-3-1-9(2-4-10)5-15-8-14-7-12-6-13-14/h1-4,6-7H,5,8,15H2
InChIKeyIAJXFNGKZLQMKC-UHFFFAOYSA-N
MW221.31 g/mol
LogP0.74
Rot. Bonds4

About (4-fluorophenyl)methyl-(1,2,4-triazol-1-ylmethyl)silane

(4-fluorophenyl)methyl-(1,2,4-triazol-1-ylmethyl)silane (PubChem CID 150513747) has the molecular formula C10H12FN3Si and a molecular weight of 221.31 g/mol. Its IUPAC name is (4-fluorophenyl)methyl-(1,2,4-triazol-1-ylmethyl)silane.

Molecular Properties

Compound Name(4-fluorophenyl)methyl-(1,2,4-triazol-1-ylmethyl)silane
PubChem CID150513747
Molecular FormulaC10H12FN3Si
Molecular Weight221.31 g/mol
Exact Mass221.08
IUPAC Name(4-fluorophenyl)methyl-(1,2,4-triazol-1-ylmethyl)silane
SMILESFc1ccc(C[SiH2]Cn2cncn2)cc1
InChIInChI=1S/C10H12FN3Si/c11-10-3-1-9(2-4-10)5-15-8-14-7-12-6-13-14/h1-4,6-7H,5,8,15H2
InChIKeyIAJXFNGKZLQMKC-UHFFFAOYSA-N
XLogP0.74
TPSA30.71 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.31
LogP ≤ 50.74
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}

Analyze (4-fluorophenyl)methyl-(1,2,4-triazol-1-ylmethyl)silane 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

bis[(4-fluorophenyl)methyl]-(1,2,4-triazol-1-ylmethyl)silane
CID 123325239
N-[(4-fluorophenyl)methyl]-2-(1,2,4-triazol-1-yl)ethanamine
CID 115595738
(1S)-1-(4-chlorophenyl)-1-(4-fluorophenyl)-2-(1,2,4-triazol-1-yl)ethanol
CID 7100274
bis(4-fluorophenyl)-methyl-[2-(1,2,4-triazol-1-yl)ethyl]silane
CID 154489904
(4-fluorophenyl)-methyl-(1,2,4-triazol-1-ylmethyl)silane
CID 154059023
1-[[3-(4-fluorophenyl)phenyl]methyl]-1,2,4-triazole
CID 23585776
1-[2-(4-fluorophenyl)-4-(4-methylphenyl)butyl]-1,2,4-triazole;hydrochloride
CID 23315452
1-[[amino-[bis(4-fluorophenyl)methyl]silyl]methyl]-1,2,4-triazole
CID 174818079
1-(4-fluorophenyl)-4,4-dimethyl-3-(1,2,4-triazol-1-ylmethyl)pentan-3-ol
CID 12763631
1-[[1-(4-fluorophenyl)cyclobutyl]methyl]-1,2,4-triazole
CID 23274489
1-[(4-methylphenyl)methyl]-1,2,4-triazole;hydrochloride
CID 20552296
(4-fluorophenyl)-methyl-phenyl-(1,2,4-triazol-1-ylmethyl)silane
CID 70499020

Frequently Asked Questions

What is the IUPAC name of (4-fluorophenyl)methyl-(1,2,4-triazol-1-ylmethyl)silane?
The IUPAC name of (4-fluorophenyl)methyl-(1,2,4-triazol-1-ylmethyl)silane (CID 150513747) is (4-fluorophenyl)methyl-(1,2,4-triazol-1-ylmethyl)silane.
What is the SMILES notation for (4-fluorophenyl)methyl-(1,2,4-triazol-1-ylmethyl)silane?
The canonical SMILES for (4-fluorophenyl)methyl-(1,2,4-triazol-1-ylmethyl)silane is Fc1ccc(C[SiH2]Cn2cncn2)cc1.
What is the InChIKey of (4-fluorophenyl)methyl-(1,2,4-triazol-1-ylmethyl)silane?
The InChIKey is IAJXFNGKZLQMKC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12FN3Si/c11-10-3-1-9(2-4-10)5-15-8-14-7-12-6-13-14/h1-4,6-7H,5,8,15H2.
What are the key properties of (4-fluorophenyl)methyl-(1,2,4-triazol-1-ylmethyl)silane?
(4-fluorophenyl)methyl-(1,2,4-triazol-1-ylmethyl)silane has a molecular weight of 221.31 g/mol, XLogP of 0.74, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (4-fluorophenyl)methyl-(1,2,4-triazol-1-ylmethyl)silane is sourced from PubChem (CID 150513747), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).