tert-butyl-dimethyl-[2-[5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)indazol-1-yl]ethoxy]silane

C21H35BN2O3Si — CID 170692410

IUPACtert-butyl-dimethyl-[2-[5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)indazol-1-yl]ethoxy]silane
SMILESCC1(C)OB(c2ccc3c(cnn3CCO[Si](C)(C)C(C)(C)C)c2)OC1(C)C
InChIInChI=1S/C21H35BN2O3Si/c1-19(2,3)28(8,9)25-13-12-24-18-11-10-17(14-16(18)15-23-24)22-26-20(4,5)21(6,7)27-22/h10-11,14-15H,12-13H2,1-9H3
InChIKeyDPQOENKWHUXCAM-UHFFFAOYSA-N
MW402.42 g/mol
LogP4.36
Rot. Bonds5

About tert-butyl-dimethyl-[2-[5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)indazol-1-yl]ethoxy]silane

tert-butyl-dimethyl-[2-[5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)indazol-1-yl]ethoxy]silane (PubChem CID 170692410) has the molecular formula C21H35BN2O3Si and a molecular weight of 402.42 g/mol. Its IUPAC name is tert-butyl-dimethyl-[2-[5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)indazol-1-yl]ethoxy]silane.

Molecular Properties

Compound Nametert-butyl-dimethyl-[2-[5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)indazol-1-yl]ethoxy]silane
PubChem CID170692410
Molecular FormulaC21H35BN2O3Si
Molecular Weight402.42 g/mol
Exact Mass402.25
IUPAC Nametert-butyl-dimethyl-[2-[5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)indazol-1-yl]ethoxy]silane
SMILESCC1(C)OB(c2ccc3c(cnn3CCO[Si](C)(C)C(C)(C)C)c2)OC1(C)C
InChIInChI=1S/C21H35BN2O3Si/c1-19(2,3)28(8,9)25-13-12-24-18-11-10-17(14-16(18)15-23-24)22-26-20(4,5)21(6,7)27-22/h10-11,14-15H,12-13H2,1-9H3
InChIKeyDPQOENKWHUXCAM-UHFFFAOYSA-N
XLogP4.36
TPSA45.51 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500402.42
LogP ≤ 54.36
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

Analyze tert-butyl-dimethyl-[2-[5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)indazol-1-yl]ethoxy]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

1-[2-[tert-butyl(dimethyl)silyl]oxyethyl]-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridin-2-one
CID 170985682
tert-butyl-dimethyl-[[3-[6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)indazol-1-yl]phenyl]methoxy]silane
CID 140798210
tert-butyl-dimethyl-[2-(5-methyl-6-nitroindazol-1-yl)ethoxy]silane
CID 58200284
tert-butyl-dimethyl-[5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)indol-1-yl]silane
CID 56973095
1-(4-fluorophenyl)-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)indazole
CID 46830501
2-(4-bromoindazol-1-yl)ethoxy-tert-butyl-dimethylsilane
CID 169069472
tert-butyl-[2-ethyl-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenoxy]-dimethylsilane
CID 167730544
2-fluoro-5-[5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)indazol-1-yl]phenol
CID 163234419
1-[2-[tert-butyl(dimethyl)silyl]oxyethyl]-5-chloropyrazol-4-amine
CID 165385908
3-[[tert-butyl(dimethyl)silyl]oxymethyl]-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)aniline
CID 90105259
tert-butyl-diphenyl-[2-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrazol-1-yl]ethoxy]silane;4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazole
CID 157133258
tert-butyl-dimethyl-[3-(1-methylindazol-6-yl)oxypropoxy]silane
CID 176655957

Frequently Asked Questions

What is the IUPAC name of tert-butyl-dimethyl-[2-[5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)indazol-1-yl]ethoxy]silane?
The IUPAC name of tert-butyl-dimethyl-[2-[5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)indazol-1-yl]ethoxy]silane (CID 170692410) is tert-butyl-dimethyl-[2-[5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)indazol-1-yl]ethoxy]silane.
What is the SMILES notation for tert-butyl-dimethyl-[2-[5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)indazol-1-yl]ethoxy]silane?
The canonical SMILES for tert-butyl-dimethyl-[2-[5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)indazol-1-yl]ethoxy]silane is CC1(C)OB(c2ccc3c(cnn3CCO[Si](C)(C)C(C)(C)C)c2)OC1(C)C.
What is the InChIKey of tert-butyl-dimethyl-[2-[5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)indazol-1-yl]ethoxy]silane?
The InChIKey is DPQOENKWHUXCAM-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H35BN2O3Si/c1-19(2,3)28(8,9)25-13-12-24-18-11-10-17(14-16(18)15-23-24)22-26-20(4,5)21(6,7)27-22/h10-11,14-15H,12-13H2,1-9H3.
What are the key properties of tert-butyl-dimethyl-[2-[5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)indazol-1-yl]ethoxy]silane?
tert-butyl-dimethyl-[2-[5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)indazol-1-yl]ethoxy]silane has a molecular weight of 402.42 g/mol, XLogP of 4.36, 5 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-dimethyl-[2-[5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)indazol-1-yl]ethoxy]silane is sourced from PubChem (CID 170692410), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).