2-(2-nitrophenyl)-1H-imidazole;trimethyl-[2-[[2-(2-nitrophenyl)imidazol-1-yl]methoxy]ethyl]silane

C24H28N6O5Si — CID 160908315

IUPAC2-(2-nitrophenyl)-1H-imidazole;trimethyl-[2-[[2-(2-nitrophenyl)imidazol-1-yl]methoxy]ethyl]silane
SMILESC[Si](C)(C)CCOCn1ccnc1-c1ccccc1[N+](=O)[O-].O=[N+]([O-])c1ccccc1-c1ncc[nH]1
InChIInChI=1S/C15H21N3O3Si.C9H7N3O2/c1-22(2,3)11-10-21-12-17-9-8-16-15(17)13-6-4-5-7-14(13)18(19)20;13-12(14)8-4-2-1-3-7(8)9-10-5-6-11-9/h4-9H,10-12H2,1-3H3;1-6H,(H,10,11)
InChIKeySQLAEACWKSBCEX-UHFFFAOYSA-N
MW508.61 g/mol
LogP5.76
Rot. Bonds9

About 2-(2-nitrophenyl)-1H-imidazole;trimethyl-[2-[[2-(2-nitrophenyl)imidazol-1-yl]methoxy]ethyl]silane

2-(2-nitrophenyl)-1H-imidazole;trimethyl-[2-[[2-(2-nitrophenyl)imidazol-1-yl]methoxy]ethyl]silane (PubChem CID 160908315) has the molecular formula C24H28N6O5Si and a molecular weight of 508.61 g/mol. Its IUPAC name is 2-(2-nitrophenyl)-1H-imidazole;trimethyl-[2-[[2-(2-nitrophenyl)imidazol-1-yl]methoxy]ethyl]silane.

Molecular Properties

Compound Name2-(2-nitrophenyl)-1H-imidazole;trimethyl-[2-[[2-(2-nitrophenyl)imidazol-1-yl]methoxy]ethyl]silane
PubChem CID160908315
Molecular FormulaC24H28N6O5Si
Molecular Weight508.61 g/mol
Exact Mass508.19
IUPAC Name2-(2-nitrophenyl)-1H-imidazole;trimethyl-[2-[[2-(2-nitrophenyl)imidazol-1-yl]methoxy]ethyl]silane
SMILESC[Si](C)(C)CCOCn1ccnc1-c1ccccc1[N+](=O)[O-].O=[N+]([O-])c1ccccc1-c1ncc[nH]1
InChIInChI=1S/C15H21N3O3Si.C9H7N3O2/c1-22(2,3)11-10-21-12-17-9-8-16-15(17)13-6-4-5-7-14(13)18(19)20;13-12(14)8-4-2-1-3-7(8)9-10-5-6-11-9/h4-9H,10-12H2,1-3H3;1-6H,(H,10,11)
InChIKeySQLAEACWKSBCEX-UHFFFAOYSA-N
XLogP5.76
TPSA142.01 Ų
H-Bond Donors1
H-Bond Acceptors8
Rotatable Bonds9
Heavy Atoms36
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500508.61
LogP ≤ 55.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 108

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'nitro_group', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze 2-(2-nitrophenyl)-1H-imidazole;trimethyl-[2-[[2-(2-nitrophenyl)imidazol-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

Related Compounds

2-[[2-[bis(1H-pyrrol-2-yl)methyl]imidazol-1-yl]methoxy]ethyl-trimethylsilane
CID 11991092
trimethyl-[2-[[4-methyl-5-[1-(2-nitrophenyl)piperidin-4-yl]imidazol-1-yl]methoxy]ethyl]silane
CID 156726733
trimethyl-[2-[(2-methyl-4-nitroimidazol-1-yl)methoxy]ethyl]silane
CID 168974471
trimethyl-[2-[[2-[4-(trifluoromethyl)phenyl]imidazol-1-yl]methoxy]ethyl]silane
CID 150281377
trimethyl-[2-[(7-nitroindazol-1-yl)methoxy]ethyl]silane
CID 171502060
phenyl-[1-(2-trimethylsilylethoxymethyl)imidazol-2-yl]methanone
CID 174251990
2-[(6-chloro-4-nitroindol-1-yl)methoxy]ethyl-trimethylsilane
CID 131736189
2-[1-(2-trimethylsilylethoxymethyl)imidazol-2-yl]pyridine-4-carboxylic acid
CID 154665027
6-[2-(1H-imidazol-2-yl)-3-pyridinyl]-8-(2-trimethylsilylethoxymethoxy)-3-(2-trimethylsilylethoxymethyl)quinazolin-4-one
CID 90257734
[3-nitro-4-[4-(trifluoromethyl)-1-(2-trimethylsilylethoxymethyl)imidazol-2-yl]phenyl]methanol
CID 169086392
N-methyl-1-(2-trimethylsilylethoxymethyl)imidazol-2-amine
CID 155615799
trimethyl-[2-[(5-nitropyrazol-1-yl)methoxy]ethyl]silane
CID 133058723

Frequently Asked Questions

What is the IUPAC name of 2-(2-nitrophenyl)-1H-imidazole;trimethyl-[2-[[2-(2-nitrophenyl)imidazol-1-yl]methoxy]ethyl]silane?
The IUPAC name of 2-(2-nitrophenyl)-1H-imidazole;trimethyl-[2-[[2-(2-nitrophenyl)imidazol-1-yl]methoxy]ethyl]silane (CID 160908315) is 2-(2-nitrophenyl)-1H-imidazole;trimethyl-[2-[[2-(2-nitrophenyl)imidazol-1-yl]methoxy]ethyl]silane.
What is the SMILES notation for 2-(2-nitrophenyl)-1H-imidazole;trimethyl-[2-[[2-(2-nitrophenyl)imidazol-1-yl]methoxy]ethyl]silane?
The canonical SMILES for 2-(2-nitrophenyl)-1H-imidazole;trimethyl-[2-[[2-(2-nitrophenyl)imidazol-1-yl]methoxy]ethyl]silane is C[Si](C)(C)CCOCn1ccnc1-c1ccccc1[N+](=O)[O-].O=[N+]([O-])c1ccccc1-c1ncc[nH]1.
What is the InChIKey of 2-(2-nitrophenyl)-1H-imidazole;trimethyl-[2-[[2-(2-nitrophenyl)imidazol-1-yl]methoxy]ethyl]silane?
The InChIKey is SQLAEACWKSBCEX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N3O3Si.C9H7N3O2/c1-22(2,3)11-10-21-12-17-9-8-16-15(17)13-6-4-5-7-14(13)18(19)20;13-12(14)8-4-2-1-3-7(8)9-10-5-6-11-9/h4-9H,10-12H2,1-3H3;1-6H,(H,10,11).
What are the key properties of 2-(2-nitrophenyl)-1H-imidazole;trimethyl-[2-[[2-(2-nitrophenyl)imidazol-1-yl]methoxy]ethyl]silane?
2-(2-nitrophenyl)-1H-imidazole;trimethyl-[2-[[2-(2-nitrophenyl)imidazol-1-yl]methoxy]ethyl]silane has a molecular weight of 508.61 g/mol, XLogP of 5.76, 9 rotatable bonds, 1 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-nitrophenyl)-1H-imidazole;trimethyl-[2-[[2-(2-nitrophenyl)imidazol-1-yl]methoxy]ethyl]silane is sourced from PubChem (CID 160908315), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).