3-(3-ethylbenzimidazol-1-ium-1-yl)propyl-trimethylsilane

C15H25N2Si+ — CID 10450042

IUPAC3-(3-ethylbenzimidazol-1-ium-1-yl)propyl-trimethylsilane
SMILESCCn1c[n+](CCC[Si](C)(C)C)c2ccccc21
InChIInChI=1S/C15H25N2Si/c1-5-16-13-17(11-8-12-18(2,3)4)15-10-7-6-9-14(15)16/h6-7,9-10,13H,5,8,11-12H2,1-4H3/q+1
InChIKeyFKTDBTBEUKYYEF-UHFFFAOYSA-N
MW261.46 g/mol
LogP3.68
Rot. Bonds5

About 3-(3-ethylbenzimidazol-1-ium-1-yl)propyl-trimethylsilane

3-(3-ethylbenzimidazol-1-ium-1-yl)propyl-trimethylsilane (PubChem CID 10450042) has the molecular formula C15H25N2Si+ and a molecular weight of 261.46 g/mol. Its IUPAC name is 3-(3-ethylbenzimidazol-1-ium-1-yl)propyl-trimethylsilane.

Molecular Properties

Compound Name3-(3-ethylbenzimidazol-1-ium-1-yl)propyl-trimethylsilane
PubChem CID10450042
Molecular FormulaC15H25N2Si+
Molecular Weight261.46 g/mol
Exact Mass261.18
IUPAC Name3-(3-ethylbenzimidazol-1-ium-1-yl)propyl-trimethylsilane
SMILESCCn1c[n+](CCC[Si](C)(C)C)c2ccccc21
InChIInChI=1S/C15H25N2Si/c1-5-16-13-17(11-8-12-18(2,3)4)15-10-7-6-9-14(15)16/h6-7,9-10,13H,5,8,11-12H2,1-4H3/q+1
InChIKeyFKTDBTBEUKYYEF-UHFFFAOYSA-N
XLogP3.68
TPSA8.81 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.46
LogP ≤ 53.68
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'quaternary_nitrogen_1', 'substructure': 'N/A'}

Analyze 3-(3-ethylbenzimidazol-1-ium-1-yl)propyl-trimethylsilane 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

trimethyl-[3-(3-prop-2-ynylbenzimidazol-1-ium-1-yl)propyl]silane
CID 11142681
3-(3-ethylbenzimidazol-1-ium-1-yl)propan-1-ol bromide
CID 89440320
6-(3-ethylbenzimidazol-1-ium-1-yl)hexan-1-ol bromide
CID 89439356
1,3-di(undecyl)benzimidazol-3-ium
CID 139045147
2-(3-ethylbenzimidazol-1-ium-1-yl)acetamide
CID 102113083
1-ethyl-3-[[3-[(3-ethylbenzimidazol-1-ium-1-yl)methyl]phenyl]methyl]benzimidazol-3-ium dibromide
CID 139239235
3-ethyl-1-[4-(3-ethyl-5-methylbenzimidazol-1-ium-1-yl)butyl]-5-methylbenzimidazol-1-ium
CID 11222632
1-prop-2-enyl-3-[3-(3-prop-2-enylbenzimidazol-1-ium-1-yl)propyl]benzimidazol-3-ium dibromide
CID 139240998
1-(dodecylsulfanylmethyl)-3-ethylbenzimidazol-1-ium
CID 10000854
1,3-di(nonyl)benzimidazol-3-ium hexafluorophosphate
CID 139045132
1-[(4-bromophenyl)methyl]-3-ethylbenzimidazol-1-ium
CID 102220583
bromomethane;1-ethyl-3-methylbenzimidazol-3-ium
CID 91100213

Frequently Asked Questions

What is the IUPAC name of 3-(3-ethylbenzimidazol-1-ium-1-yl)propyl-trimethylsilane?
The IUPAC name of 3-(3-ethylbenzimidazol-1-ium-1-yl)propyl-trimethylsilane (CID 10450042) is 3-(3-ethylbenzimidazol-1-ium-1-yl)propyl-trimethylsilane.
What is the SMILES notation for 3-(3-ethylbenzimidazol-1-ium-1-yl)propyl-trimethylsilane?
The canonical SMILES for 3-(3-ethylbenzimidazol-1-ium-1-yl)propyl-trimethylsilane is CCn1c[n+](CCC[Si](C)(C)C)c2ccccc21.
What is the InChIKey of 3-(3-ethylbenzimidazol-1-ium-1-yl)propyl-trimethylsilane?
The InChIKey is FKTDBTBEUKYYEF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N2Si/c1-5-16-13-17(11-8-12-18(2,3)4)15-10-7-6-9-14(15)16/h6-7,9-10,13H,5,8,11-12H2,1-4H3/q+1.
What are the key properties of 3-(3-ethylbenzimidazol-1-ium-1-yl)propyl-trimethylsilane?
3-(3-ethylbenzimidazol-1-ium-1-yl)propyl-trimethylsilane has a molecular weight of 261.46 g/mol, XLogP of 3.68, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3-ethylbenzimidazol-1-ium-1-yl)propyl-trimethylsilane is sourced from PubChem (CID 10450042), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).