2-(1,2-dimethylbenzimidazol-5-yl)ethynyl-trimethylsilane

C14H18N2Si — CID 162381740

IUPAC2-(1,2-dimethylbenzimidazol-5-yl)ethynyl-trimethylsilane
SMILESCc1nc2cc(C#C[Si](C)(C)C)ccc2n1C
InChIInChI=1S/C14H18N2Si/c1-11-15-13-10-12(8-9-17(3,4)5)6-7-14(13)16(11)2/h6-7,10H,1-5H3
InChIKeyNYXFPFZYDJEWKW-UHFFFAOYSA-N
MW242.40 g/mol
LogP3.11
Rot. Bonds

About 2-(1,2-dimethylbenzimidazol-5-yl)ethynyl-trimethylsilane

2-(1,2-dimethylbenzimidazol-5-yl)ethynyl-trimethylsilane (PubChem CID 162381740) has the molecular formula C14H18N2Si and a molecular weight of 242.40 g/mol. Its IUPAC name is 2-(1,2-dimethylbenzimidazol-5-yl)ethynyl-trimethylsilane.

Molecular Properties

Compound Name2-(1,2-dimethylbenzimidazol-5-yl)ethynyl-trimethylsilane
PubChem CID162381740
Molecular FormulaC14H18N2Si
Molecular Weight242.40 g/mol
Exact Mass242.12
IUPAC Name2-(1,2-dimethylbenzimidazol-5-yl)ethynyl-trimethylsilane
SMILESCc1nc2cc(C#C[Si](C)(C)C)ccc2n1C
InChIInChI=1S/C14H18N2Si/c1-11-15-13-10-12(8-9-17(3,4)5)6-7-14(13)16(11)2/h6-7,10H,1-5H3
InChIKeyNYXFPFZYDJEWKW-UHFFFAOYSA-N
XLogP3.11
TPSA17.82 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.40
LogP ≤ 53.11
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze 2-(1,2-dimethylbenzimidazol-5-yl)ethynyl-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-(1,2-dimethylbenzimidazol-5-yl)ethynyl-trimethylsilane?
The IUPAC name of 2-(1,2-dimethylbenzimidazol-5-yl)ethynyl-trimethylsilane (CID 162381740) is 2-(1,2-dimethylbenzimidazol-5-yl)ethynyl-trimethylsilane.
What is the SMILES notation for 2-(1,2-dimethylbenzimidazol-5-yl)ethynyl-trimethylsilane?
The canonical SMILES for 2-(1,2-dimethylbenzimidazol-5-yl)ethynyl-trimethylsilane is Cc1nc2cc(C#C[Si](C)(C)C)ccc2n1C.
What is the InChIKey of 2-(1,2-dimethylbenzimidazol-5-yl)ethynyl-trimethylsilane?
The InChIKey is NYXFPFZYDJEWKW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N2Si/c1-11-15-13-10-12(8-9-17(3,4)5)6-7-14(13)16(11)2/h6-7,10H,1-5H3.
What are the key properties of 2-(1,2-dimethylbenzimidazol-5-yl)ethynyl-trimethylsilane?
2-(1,2-dimethylbenzimidazol-5-yl)ethynyl-trimethylsilane has a molecular weight of 242.40 g/mol, XLogP of 3.11, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1,2-dimethylbenzimidazol-5-yl)ethynyl-trimethylsilane is sourced from PubChem (CID 162381740), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).