2-[[6-fluoro-5-(1-methylpyrazol-4-yl)indazol-2-yl]methoxy]ethyl-trimethylsilane

C17H23FN4OSi — CID 90398408

IUPAC2-[[6-fluoro-5-(1-methylpyrazol-4-yl)indazol-2-yl]methoxy]ethyl-trimethylsilane
SMILESCn1cc(-c2cc3cn(COCC[Si](C)(C)C)nc3cc2F)cn1
InChIInChI=1S/C17H23FN4OSi/c1-21-10-14(9-19-21)15-7-13-11-22(20-17(13)8-16(15)18)12-23-5-6-24(2,3)4/h7-11H,5-6,12H2,1-4H3
InChIKeyNGRUWFVLOVRCQS-UHFFFAOYSA-N
MW346.48 g/mol
LogP3.89
Rot. Bonds6

About 2-[[6-fluoro-5-(1-methylpyrazol-4-yl)indazol-2-yl]methoxy]ethyl-trimethylsilane

2-[[6-fluoro-5-(1-methylpyrazol-4-yl)indazol-2-yl]methoxy]ethyl-trimethylsilane (PubChem CID 90398408) has the molecular formula C17H23FN4OSi and a molecular weight of 346.48 g/mol. Its IUPAC name is 2-[[6-fluoro-5-(1-methylpyrazol-4-yl)indazol-2-yl]methoxy]ethyl-trimethylsilane.

Molecular Properties

Compound Name2-[[6-fluoro-5-(1-methylpyrazol-4-yl)indazol-2-yl]methoxy]ethyl-trimethylsilane
PubChem CID90398408
Molecular FormulaC17H23FN4OSi
Molecular Weight346.48 g/mol
Exact Mass346.16
IUPAC Name2-[[6-fluoro-5-(1-methylpyrazol-4-yl)indazol-2-yl]methoxy]ethyl-trimethylsilane
SMILESCn1cc(-c2cc3cn(COCC[Si](C)(C)C)nc3cc2F)cn1
InChIInChI=1S/C17H23FN4OSi/c1-21-10-14(9-19-21)15-7-13-11-22(20-17(13)8-16(15)18)12-23-5-6-24(2,3)4/h7-11H,5-6,12H2,1-4H3
InChIKeyNGRUWFVLOVRCQS-UHFFFAOYSA-N
XLogP3.89
TPSA44.87 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500346.48
LogP ≤ 53.89
H-Bond Donors ≤ 50
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 2-[[6-fluoro-5-(1-methylpyrazol-4-yl)indazol-2-yl]methoxy]ethyl-trimethylsilane 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 2-[[6-fluoro-5-(1-methylpyrazol-4-yl)indazol-2-yl]methoxy]ethyl-trimethylsilane?
The IUPAC name of 2-[[6-fluoro-5-(1-methylpyrazol-4-yl)indazol-2-yl]methoxy]ethyl-trimethylsilane (CID 90398408) is 2-[[6-fluoro-5-(1-methylpyrazol-4-yl)indazol-2-yl]methoxy]ethyl-trimethylsilane.
What is the SMILES notation for 2-[[6-fluoro-5-(1-methylpyrazol-4-yl)indazol-2-yl]methoxy]ethyl-trimethylsilane?
The canonical SMILES for 2-[[6-fluoro-5-(1-methylpyrazol-4-yl)indazol-2-yl]methoxy]ethyl-trimethylsilane is Cn1cc(-c2cc3cn(COCC[Si](C)(C)C)nc3cc2F)cn1.
What is the InChIKey of 2-[[6-fluoro-5-(1-methylpyrazol-4-yl)indazol-2-yl]methoxy]ethyl-trimethylsilane?
The InChIKey is NGRUWFVLOVRCQS-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H23FN4OSi/c1-21-10-14(9-19-21)15-7-13-11-22(20-17(13)8-16(15)18)12-23-5-6-24(2,3)4/h7-11H,5-6,12H2,1-4H3.
What are the key properties of 2-[[6-fluoro-5-(1-methylpyrazol-4-yl)indazol-2-yl]methoxy]ethyl-trimethylsilane?
2-[[6-fluoro-5-(1-methylpyrazol-4-yl)indazol-2-yl]methoxy]ethyl-trimethylsilane has a molecular weight of 346.48 g/mol, XLogP of 3.89, 6 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[6-fluoro-5-(1-methylpyrazol-4-yl)indazol-2-yl]methoxy]ethyl-trimethylsilane is sourced from PubChem (CID 90398408), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).