2-[[2-[bis(1H-pyrrol-2-yl)methyl]imidazol-1-yl]methoxy]ethyl-trimethylsilane

C18H26N4OSi — CID 11991092

IUPAC2-[[2-[bis(1H-pyrrol-2-yl)methyl]imidazol-1-yl]methoxy]ethyl-trimethylsilane
SMILESC[Si](C)(C)CCOCn1ccnc1C(c1ccc[nH]1)c1ccc[nH]1
InChIInChI=1S/C18H26N4OSi/c1-24(2,3)13-12-23-14-22-11-10-21-18(22)17(15-6-4-8-19-15)16-7-5-9-20-16/h4-11,17,19-20H,12-14H2,1-3H3
InChIKeyGRIXRPVPWTVGFD-UHFFFAOYSA-N
MW342.52 g/mol
LogP4.03
Rot. Bonds8

About 2-[[2-[bis(1H-pyrrol-2-yl)methyl]imidazol-1-yl]methoxy]ethyl-trimethylsilane

2-[[2-[bis(1H-pyrrol-2-yl)methyl]imidazol-1-yl]methoxy]ethyl-trimethylsilane (PubChem CID 11991092) has the molecular formula C18H26N4OSi and a molecular weight of 342.52 g/mol. Its IUPAC name is 2-[[2-[bis(1H-pyrrol-2-yl)methyl]imidazol-1-yl]methoxy]ethyl-trimethylsilane.

Molecular Properties

Compound Name2-[[2-[bis(1H-pyrrol-2-yl)methyl]imidazol-1-yl]methoxy]ethyl-trimethylsilane
PubChem CID11991092
Molecular FormulaC18H26N4OSi
Molecular Weight342.52 g/mol
Exact Mass342.19
IUPAC Name2-[[2-[bis(1H-pyrrol-2-yl)methyl]imidazol-1-yl]methoxy]ethyl-trimethylsilane
SMILESC[Si](C)(C)CCOCn1ccnc1C(c1ccc[nH]1)c1ccc[nH]1
InChIInChI=1S/C18H26N4OSi/c1-24(2,3)13-12-23-14-22-11-10-21-18(22)17(15-6-4-8-19-15)16-7-5-9-20-16/h4-11,17,19-20H,12-14H2,1-3H3
InChIKeyGRIXRPVPWTVGFD-UHFFFAOYSA-N
XLogP4.03
TPSA58.63 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500342.52
LogP ≤ 54.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze 2-[[2-[bis(1H-pyrrol-2-yl)methyl]imidazol-1-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-[[2-[bis(1H-pyrrol-2-yl)methyl]imidazol-1-yl]methoxy]ethyl-trimethylsilane?
The IUPAC name of 2-[[2-[bis(1H-pyrrol-2-yl)methyl]imidazol-1-yl]methoxy]ethyl-trimethylsilane (CID 11991092) is 2-[[2-[bis(1H-pyrrol-2-yl)methyl]imidazol-1-yl]methoxy]ethyl-trimethylsilane.
What is the SMILES notation for 2-[[2-[bis(1H-pyrrol-2-yl)methyl]imidazol-1-yl]methoxy]ethyl-trimethylsilane?
The canonical SMILES for 2-[[2-[bis(1H-pyrrol-2-yl)methyl]imidazol-1-yl]methoxy]ethyl-trimethylsilane is C[Si](C)(C)CCOCn1ccnc1C(c1ccc[nH]1)c1ccc[nH]1.
What is the InChIKey of 2-[[2-[bis(1H-pyrrol-2-yl)methyl]imidazol-1-yl]methoxy]ethyl-trimethylsilane?
The InChIKey is GRIXRPVPWTVGFD-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H26N4OSi/c1-24(2,3)13-12-23-14-22-11-10-21-18(22)17(15-6-4-8-19-15)16-7-5-9-20-16/h4-11,17,19-20H,12-14H2,1-3H3.
What are the key properties of 2-[[2-[bis(1H-pyrrol-2-yl)methyl]imidazol-1-yl]methoxy]ethyl-trimethylsilane?
2-[[2-[bis(1H-pyrrol-2-yl)methyl]imidazol-1-yl]methoxy]ethyl-trimethylsilane has a molecular weight of 342.52 g/mol, XLogP of 4.03, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[2-[bis(1H-pyrrol-2-yl)methyl]imidazol-1-yl]methoxy]ethyl-trimethylsilane is sourced from PubChem (CID 11991092), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).