(1-benzyl-2,5-dimethylindol-3-yl)oxy-tert-butyl-dimethylsilane

C23H31NOSi — CID 135009014

IUPAC(1-benzyl-2,5-dimethylindol-3-yl)oxy-tert-butyl-dimethylsilane
SMILESCc1ccc2c(c1)c(O[Si](C)(C)C(C)(C)C)c(C)n2Cc1ccccc1
InChIInChI=1S/C23H31NOSi/c1-17-13-14-21-20(15-17)22(25-26(6,7)23(3,4)5)18(2)24(21)16-19-11-9-8-10-12-19/h8-15H,16H2,1-7H3
InChIKeyJGXURYXYQDRRHX-UHFFFAOYSA-N
MW365.59 g/mol
LogP6.69
Rot. Bonds4

About (1-benzyl-2,5-dimethylindol-3-yl)oxy-tert-butyl-dimethylsilane

(1-benzyl-2,5-dimethylindol-3-yl)oxy-tert-butyl-dimethylsilane (PubChem CID 135009014) has the molecular formula C23H31NOSi and a molecular weight of 365.59 g/mol. Its IUPAC name is (1-benzyl-2,5-dimethylindol-3-yl)oxy-tert-butyl-dimethylsilane.

Molecular Properties

Compound Name(1-benzyl-2,5-dimethylindol-3-yl)oxy-tert-butyl-dimethylsilane
PubChem CID135009014
Molecular FormulaC23H31NOSi
Molecular Weight365.59 g/mol
Exact Mass365.22
IUPAC Name(1-benzyl-2,5-dimethylindol-3-yl)oxy-tert-butyl-dimethylsilane
SMILESCc1ccc2c(c1)c(O[Si](C)(C)C(C)(C)C)c(C)n2Cc1ccccc1
InChIInChI=1S/C23H31NOSi/c1-17-13-14-21-20(15-17)22(25-26(6,7)23(3,4)5)18(2)24(21)16-19-11-9-8-10-12-19/h8-15H,16H2,1-7H3
InChIKeyJGXURYXYQDRRHX-UHFFFAOYSA-N
XLogP6.69
TPSA14.16 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500365.59
LogP ≤ 56.69
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

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CID 58159616
4-[(2,3,5-trimethylindol-1-yl)methyl]phenol
CID 143599776
5-benzyl-8-methyl-3-methylsulfanyl-[1,2,4]triazino[5,6-b]indole
CID 6400963
1-benzyl-5-methyl-2-(4-methylphenyl)benzimidazole
CID 12620886
4-benzyl-1,7-dimethyl-[1,2,4]triazolo[4,3-a]quinazolin-5-one
CID 20755137
5-[(4-fluorophenyl)methyl]-8-methyl-3-(2-phenylethyl)pyrimido[5,4-b]indol-4-one
CID 53026598

Frequently Asked Questions

What is the IUPAC name of (1-benzyl-2,5-dimethylindol-3-yl)oxy-tert-butyl-dimethylsilane?
The IUPAC name of (1-benzyl-2,5-dimethylindol-3-yl)oxy-tert-butyl-dimethylsilane (CID 135009014) is (1-benzyl-2,5-dimethylindol-3-yl)oxy-tert-butyl-dimethylsilane.
What is the SMILES notation for (1-benzyl-2,5-dimethylindol-3-yl)oxy-tert-butyl-dimethylsilane?
The canonical SMILES for (1-benzyl-2,5-dimethylindol-3-yl)oxy-tert-butyl-dimethylsilane is Cc1ccc2c(c1)c(O[Si](C)(C)C(C)(C)C)c(C)n2Cc1ccccc1.
What is the InChIKey of (1-benzyl-2,5-dimethylindol-3-yl)oxy-tert-butyl-dimethylsilane?
The InChIKey is JGXURYXYQDRRHX-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H31NOSi/c1-17-13-14-21-20(15-17)22(25-26(6,7)23(3,4)5)18(2)24(21)16-19-11-9-8-10-12-19/h8-15H,16H2,1-7H3.
What are the key properties of (1-benzyl-2,5-dimethylindol-3-yl)oxy-tert-butyl-dimethylsilane?
(1-benzyl-2,5-dimethylindol-3-yl)oxy-tert-butyl-dimethylsilane has a molecular weight of 365.59 g/mol, XLogP of 6.69, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1-benzyl-2,5-dimethylindol-3-yl)oxy-tert-butyl-dimethylsilane is sourced from PubChem (CID 135009014), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).