(2-methylphenyl)methyl-(1,2,4-triazol-1-yl)silane

C10H13N3Si — CID 150697284

IUPAC(2-methylphenyl)methyl-(1,2,4-triazol-1-yl)silane
SMILESCc1ccccc1C[SiH2]n1cncn1
InChIInChI=1S/C10H13N3Si/c1-9-4-2-3-5-10(9)6-14-13-8-11-7-12-13/h2-5,7-8H,6,14H2,1H3
InChIKeyJLCMWIDEWIMEDK-UHFFFAOYSA-N
MW203.32 g/mol
LogP0.72
Rot. Bonds3

About (2-methylphenyl)methyl-(1,2,4-triazol-1-yl)silane

(2-methylphenyl)methyl-(1,2,4-triazol-1-yl)silane (PubChem CID 150697284) has the molecular formula C10H13N3Si and a molecular weight of 203.32 g/mol. Its IUPAC name is (2-methylphenyl)methyl-(1,2,4-triazol-1-yl)silane.

Molecular Properties

Compound Name(2-methylphenyl)methyl-(1,2,4-triazol-1-yl)silane
PubChem CID150697284
Molecular FormulaC10H13N3Si
Molecular Weight203.32 g/mol
Exact Mass203.09
IUPAC Name(2-methylphenyl)methyl-(1,2,4-triazol-1-yl)silane
SMILESCc1ccccc1C[SiH2]n1cncn1
InChIInChI=1S/C10H13N3Si/c1-9-4-2-3-5-10(9)6-14-13-8-11-7-12-13/h2-5,7-8H,6,14H2,1H3
InChIKeyJLCMWIDEWIMEDK-UHFFFAOYSA-N
XLogP0.72
TPSA30.71 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.32
LogP ≤ 50.72
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze (2-methylphenyl)methyl-(1,2,4-triazol-1-yl)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

1-[2-(2-methylphenyl)ethyl]-1,2,4-triazole
CID 173307383
N-[(2-methylphenyl)methyl]-2-(1,2,4-triazol-1-yl)aniline
CID 43426538
(2R)-N-[(2-methylphenyl)methyl]-2-(1,2,4-triazol-1-yl)propanamide
CID 34950969
N-[(2-methylphenyl)methyl]-6-(1,2,4-triazol-1-yl)pyridin-3-amine
CID 43691536
4-chloro-N-[(2-methylphenyl)methyl]-6-(1,2,4-triazol-1-yl)-1,3,5-triazin-2-amine
CID 62863026
(2R)-N-[4-[[2-(2-methylphenyl)acetyl]amino]phenyl]-2-(1,2,4-triazol-1-yl)propanamide
CID 32592112
2-(2-methylphenyl)-N-[6-(1,2,4-triazol-1-yl)pyrimidin-4-yl]acetamide
CID 71805433
2-(2-methylphenyl)-1-[4-[6-(1,2,4-triazol-1-yl)pyridazin-3-yl]piperazin-1-yl]ethanone
CID 121145945
CID 165401665
CID 165401665
2-methyl-6-[[2-(1,2,4-triazol-1-yl)anilino]methyl]phenol
CID 115951256
1-[3,3-dimethyl-2-[5-(2-methylphenyl)pentoxy]but-1-enyl]-1,2,4-triazole
CID 70459117
1-(chloromethyl)-2-methylbenzene
CID 11093

Frequently Asked Questions

What is the IUPAC name of (2-methylphenyl)methyl-(1,2,4-triazol-1-yl)silane?
The IUPAC name of (2-methylphenyl)methyl-(1,2,4-triazol-1-yl)silane (CID 150697284) is (2-methylphenyl)methyl-(1,2,4-triazol-1-yl)silane.
What is the SMILES notation for (2-methylphenyl)methyl-(1,2,4-triazol-1-yl)silane?
The canonical SMILES for (2-methylphenyl)methyl-(1,2,4-triazol-1-yl)silane is Cc1ccccc1C[SiH2]n1cncn1.
What is the InChIKey of (2-methylphenyl)methyl-(1,2,4-triazol-1-yl)silane?
The InChIKey is JLCMWIDEWIMEDK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13N3Si/c1-9-4-2-3-5-10(9)6-14-13-8-11-7-12-13/h2-5,7-8H,6,14H2,1H3.
What are the key properties of (2-methylphenyl)methyl-(1,2,4-triazol-1-yl)silane?
(2-methylphenyl)methyl-(1,2,4-triazol-1-yl)silane has a molecular weight of 203.32 g/mol, XLogP of 0.72, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2-methylphenyl)methyl-(1,2,4-triazol-1-yl)silane is sourced from PubChem (CID 150697284), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).