2-[(6,6-dimethyl-5,7-dihydro-4H-indazol-1-yl)methoxy]ethyl-trimethylsilane

C15H28N2OSi — CID 141401665

IUPAC2-[(6,6-dimethyl-5,7-dihydro-4H-indazol-1-yl)methoxy]ethyl-trimethylsilane
SMILESCC1(C)CCc2cnn(COCC[Si](C)(C)C)c2C1
InChIInChI=1S/C15H28N2OSi/c1-15(2)7-6-13-11-16-17(14(13)10-15)12-18-8-9-19(3,4)5/h11H,6-10,12H2,1-5H3
InChIKeySWIBYARCGFOUTC-UHFFFAOYSA-N
MW280.49 g/mol
LogP3.71
Rot. Bonds5

About 2-[(6,6-dimethyl-5,7-dihydro-4H-indazol-1-yl)methoxy]ethyl-trimethylsilane

2-[(6,6-dimethyl-5,7-dihydro-4H-indazol-1-yl)methoxy]ethyl-trimethylsilane (PubChem CID 141401665) has the molecular formula C15H28N2OSi and a molecular weight of 280.49 g/mol. Its IUPAC name is 2-[(6,6-dimethyl-5,7-dihydro-4H-indazol-1-yl)methoxy]ethyl-trimethylsilane.

Molecular Properties

Compound Name2-[(6,6-dimethyl-5,7-dihydro-4H-indazol-1-yl)methoxy]ethyl-trimethylsilane
PubChem CID141401665
Molecular FormulaC15H28N2OSi
Molecular Weight280.49 g/mol
Exact Mass280.20
IUPAC Name2-[(6,6-dimethyl-5,7-dihydro-4H-indazol-1-yl)methoxy]ethyl-trimethylsilane
SMILESCC1(C)CCc2cnn(COCC[Si](C)(C)C)c2C1
InChIInChI=1S/C15H28N2OSi/c1-15(2)7-6-13-11-16-17(14(13)10-15)12-18-8-9-19(3,4)5/h11H,6-10,12H2,1-5H3
InChIKeySWIBYARCGFOUTC-UHFFFAOYSA-N
XLogP3.71
TPSA27.05 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.49
LogP ≤ 53.71
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-[(6,6-dimethyl-5,7-dihydro-4H-indazol-1-yl)methoxy]ethyl-trimethylsilane?
The IUPAC name of 2-[(6,6-dimethyl-5,7-dihydro-4H-indazol-1-yl)methoxy]ethyl-trimethylsilane (CID 141401665) is 2-[(6,6-dimethyl-5,7-dihydro-4H-indazol-1-yl)methoxy]ethyl-trimethylsilane.
What is the SMILES notation for 2-[(6,6-dimethyl-5,7-dihydro-4H-indazol-1-yl)methoxy]ethyl-trimethylsilane?
The canonical SMILES for 2-[(6,6-dimethyl-5,7-dihydro-4H-indazol-1-yl)methoxy]ethyl-trimethylsilane is CC1(C)CCc2cnn(COCC[Si](C)(C)C)c2C1.
What is the InChIKey of 2-[(6,6-dimethyl-5,7-dihydro-4H-indazol-1-yl)methoxy]ethyl-trimethylsilane?
The InChIKey is SWIBYARCGFOUTC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28N2OSi/c1-15(2)7-6-13-11-16-17(14(13)10-15)12-18-8-9-19(3,4)5/h11H,6-10,12H2,1-5H3.
What are the key properties of 2-[(6,6-dimethyl-5,7-dihydro-4H-indazol-1-yl)methoxy]ethyl-trimethylsilane?
2-[(6,6-dimethyl-5,7-dihydro-4H-indazol-1-yl)methoxy]ethyl-trimethylsilane has a molecular weight of 280.49 g/mol, XLogP of 3.71, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(6,6-dimethyl-5,7-dihydro-4H-indazol-1-yl)methoxy]ethyl-trimethylsilane is sourced from PubChem (CID 141401665), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).