2-[1-(1H-imidazol-3-ium-3-yl)cyclohexyl]ethylsilane

C11H21N2Si+ — CID 175389182

IUPAC2-[1-(1H-imidazol-3-ium-3-yl)cyclohexyl]ethylsilane
SMILES[SiH3]CCC1([n+]2cc[nH]c2)CCCCC1
InChIInChI=1S/C11H20N2Si/c14-9-6-11(4-2-1-3-5-11)13-8-7-12-10-13/h7-8,10H,1-6,9H2,14H3/p+1
InChIKeyAHGPRRKDJFMMSZ-UHFFFAOYSA-O
MW209.39 g/mol
LogP1.14
Rot. Bonds3

About 2-[1-(1H-imidazol-3-ium-3-yl)cyclohexyl]ethylsilane

2-[1-(1H-imidazol-3-ium-3-yl)cyclohexyl]ethylsilane (PubChem CID 175389182) has the molecular formula C11H21N2Si+ and a molecular weight of 209.39 g/mol. Its IUPAC name is 2-[1-(1H-imidazol-3-ium-3-yl)cyclohexyl]ethylsilane.

Molecular Properties

Compound Name2-[1-(1H-imidazol-3-ium-3-yl)cyclohexyl]ethylsilane
PubChem CID175389182
Molecular FormulaC11H21N2Si+
Molecular Weight209.39 g/mol
Exact Mass209.15
IUPAC Name2-[1-(1H-imidazol-3-ium-3-yl)cyclohexyl]ethylsilane
SMILES[SiH3]CCC1([n+]2cc[nH]c2)CCCCC1
InChIInChI=1S/C11H20N2Si/c14-9-6-11(4-2-1-3-5-11)13-8-7-12-10-13/h7-8,10H,1-6,9H2,14H3/p+1
InChIKeyAHGPRRKDJFMMSZ-UHFFFAOYSA-O
XLogP1.14
TPSA19.67 Ų
H-Bond Donors1
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.39
LogP ≤ 51.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-[1-(1H-imidazol-3-ium-3-yl)cyclohexyl]ethylsilane?
The IUPAC name of 2-[1-(1H-imidazol-3-ium-3-yl)cyclohexyl]ethylsilane (CID 175389182) is 2-[1-(1H-imidazol-3-ium-3-yl)cyclohexyl]ethylsilane.
What is the SMILES notation for 2-[1-(1H-imidazol-3-ium-3-yl)cyclohexyl]ethylsilane?
The canonical SMILES for 2-[1-(1H-imidazol-3-ium-3-yl)cyclohexyl]ethylsilane is [SiH3]CCC1([n+]2cc[nH]c2)CCCCC1.
What is the InChIKey of 2-[1-(1H-imidazol-3-ium-3-yl)cyclohexyl]ethylsilane?
The InChIKey is AHGPRRKDJFMMSZ-UHFFFAOYSA-O. The full InChI is InChI=1S/C11H20N2Si/c14-9-6-11(4-2-1-3-5-11)13-8-7-12-10-13/h7-8,10H,1-6,9H2,14H3/p+1.
What are the key properties of 2-[1-(1H-imidazol-3-ium-3-yl)cyclohexyl]ethylsilane?
2-[1-(1H-imidazol-3-ium-3-yl)cyclohexyl]ethylsilane has a molecular weight of 209.39 g/mol, XLogP of 1.14, 3 rotatable bonds, 1 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-(1H-imidazol-3-ium-3-yl)cyclohexyl]ethylsilane is sourced from PubChem (CID 175389182), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).