trimethyl-[2-[[6-pentyl-3-(2H-triazol-4-yl)indazol-1-yl]methoxy]ethyl]silane

C20H31N5OSi — CID 58515219

IUPACtrimethyl-[2-[[6-pentyl-3-(2H-triazol-4-yl)indazol-1-yl]methoxy]ethyl]silane
SMILESCCCCCc1ccc2c(-c3cn[nH]n3)nn(COCC[Si](C)(C)C)c2c1
InChIInChI=1S/C20H31N5OSi/c1-5-6-7-8-16-9-10-17-19(13-16)25(15-26-11-12-27(2,3)4)23-20(17)18-14-21-24-22-18/h9-10,13-14H,5-8,11-12,15H2,1-4H3,(H,21,22,24)
InChIKeyCOVSKWBMYSVHJJ-UHFFFAOYSA-N
MW385.59 g/mol
LogP4.87
Rot. Bonds10

About trimethyl-[2-[[6-pentyl-3-(2H-triazol-4-yl)indazol-1-yl]methoxy]ethyl]silane

trimethyl-[2-[[6-pentyl-3-(2H-triazol-4-yl)indazol-1-yl]methoxy]ethyl]silane (PubChem CID 58515219) has the molecular formula C20H31N5OSi and a molecular weight of 385.59 g/mol. Its IUPAC name is trimethyl-[2-[[6-pentyl-3-(2H-triazol-4-yl)indazol-1-yl]methoxy]ethyl]silane.

Molecular Properties

Compound Nametrimethyl-[2-[[6-pentyl-3-(2H-triazol-4-yl)indazol-1-yl]methoxy]ethyl]silane
PubChem CID58515219
Molecular FormulaC20H31N5OSi
Molecular Weight385.59 g/mol
Exact Mass385.23
IUPAC Nametrimethyl-[2-[[6-pentyl-3-(2H-triazol-4-yl)indazol-1-yl]methoxy]ethyl]silane
SMILESCCCCCc1ccc2c(-c3cn[nH]n3)nn(COCC[Si](C)(C)C)c2c1
InChIInChI=1S/C20H31N5OSi/c1-5-6-7-8-16-9-10-17-19(13-16)25(15-26-11-12-27(2,3)4)23-20(17)18-14-21-24-22-18/h9-10,13-14H,5-8,11-12,15H2,1-4H3,(H,21,22,24)
InChIKeyCOVSKWBMYSVHJJ-UHFFFAOYSA-N
XLogP4.87
TPSA68.62 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds10
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500385.59
LogP ≤ 54.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

Analyze trimethyl-[2-[[6-pentyl-3-(2H-triazol-4-yl)indazol-1-yl]methoxy]ethyl]silane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of trimethyl-[2-[[6-pentyl-3-(2H-triazol-4-yl)indazol-1-yl]methoxy]ethyl]silane?
The IUPAC name of trimethyl-[2-[[6-pentyl-3-(2H-triazol-4-yl)indazol-1-yl]methoxy]ethyl]silane (CID 58515219) is trimethyl-[2-[[6-pentyl-3-(2H-triazol-4-yl)indazol-1-yl]methoxy]ethyl]silane.
What is the SMILES notation for trimethyl-[2-[[6-pentyl-3-(2H-triazol-4-yl)indazol-1-yl]methoxy]ethyl]silane?
The canonical SMILES for trimethyl-[2-[[6-pentyl-3-(2H-triazol-4-yl)indazol-1-yl]methoxy]ethyl]silane is CCCCCc1ccc2c(-c3cn[nH]n3)nn(COCC[Si](C)(C)C)c2c1.
What is the InChIKey of trimethyl-[2-[[6-pentyl-3-(2H-triazol-4-yl)indazol-1-yl]methoxy]ethyl]silane?
The InChIKey is COVSKWBMYSVHJJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H31N5OSi/c1-5-6-7-8-16-9-10-17-19(13-16)25(15-26-11-12-27(2,3)4)23-20(17)18-14-21-24-22-18/h9-10,13-14H,5-8,11-12,15H2,1-4H3,(H,21,22,24).
What are the key properties of trimethyl-[2-[[6-pentyl-3-(2H-triazol-4-yl)indazol-1-yl]methoxy]ethyl]silane?
trimethyl-[2-[[6-pentyl-3-(2H-triazol-4-yl)indazol-1-yl]methoxy]ethyl]silane has a molecular weight of 385.59 g/mol, XLogP of 4.87, 10 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for trimethyl-[2-[[6-pentyl-3-(2H-triazol-4-yl)indazol-1-yl]methoxy]ethyl]silane is sourced from PubChem (CID 58515219), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).