tert-butyl-dimethyl-[(7-methyl-2,3-dihydro-1H-pyrrolo[1,2-a]indol-8-yl)oxy]silane

C18H27NOSi — CID 71467272

IUPACtert-butyl-dimethyl-[(7-methyl-2,3-dihydro-1H-pyrrolo[1,2-a]indol-8-yl)oxy]silane
SMILESCc1ccc2cc3n(c2c1O[Si](C)(C)C(C)(C)C)CCC3
InChIInChI=1S/C18H27NOSi/c1-13-9-10-14-12-15-8-7-11-19(15)16(14)17(13)20-21(5,6)18(2,3)4/h9-10,12H,7-8,11H2,1-6H3
InChIKeyCDNZXRZPTAMDDL-UHFFFAOYSA-N
MW301.51 g/mol
LogP5.28
Rot. Bonds2

About tert-butyl-dimethyl-[(7-methyl-2,3-dihydro-1H-pyrrolo[1,2-a]indol-8-yl)oxy]silane

tert-butyl-dimethyl-[(7-methyl-2,3-dihydro-1H-pyrrolo[1,2-a]indol-8-yl)oxy]silane (PubChem CID 71467272) has the molecular formula C18H27NOSi and a molecular weight of 301.51 g/mol. Its IUPAC name is tert-butyl-dimethyl-[(7-methyl-2,3-dihydro-1H-pyrrolo[1,2-a]indol-8-yl)oxy]silane.

Molecular Properties

Compound Nametert-butyl-dimethyl-[(7-methyl-2,3-dihydro-1H-pyrrolo[1,2-a]indol-8-yl)oxy]silane
PubChem CID71467272
Molecular FormulaC18H27NOSi
Molecular Weight301.51 g/mol
Exact Mass301.19
IUPAC Nametert-butyl-dimethyl-[(7-methyl-2,3-dihydro-1H-pyrrolo[1,2-a]indol-8-yl)oxy]silane
SMILESCc1ccc2cc3n(c2c1O[Si](C)(C)C(C)(C)C)CCC3
InChIInChI=1S/C18H27NOSi/c1-13-9-10-14-12-15-8-7-11-19(15)16(14)17(13)20-21(5,6)18(2,3)4/h9-10,12H,7-8,11H2,1-6H3
InChIKeyCDNZXRZPTAMDDL-UHFFFAOYSA-N
XLogP5.28
TPSA14.16 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500301.51
LogP ≤ 55.28
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of tert-butyl-dimethyl-[(7-methyl-2,3-dihydro-1H-pyrrolo[1,2-a]indol-8-yl)oxy]silane?
The IUPAC name of tert-butyl-dimethyl-[(7-methyl-2,3-dihydro-1H-pyrrolo[1,2-a]indol-8-yl)oxy]silane (CID 71467272) is tert-butyl-dimethyl-[(7-methyl-2,3-dihydro-1H-pyrrolo[1,2-a]indol-8-yl)oxy]silane.
What is the SMILES notation for tert-butyl-dimethyl-[(7-methyl-2,3-dihydro-1H-pyrrolo[1,2-a]indol-8-yl)oxy]silane?
The canonical SMILES for tert-butyl-dimethyl-[(7-methyl-2,3-dihydro-1H-pyrrolo[1,2-a]indol-8-yl)oxy]silane is Cc1ccc2cc3n(c2c1O[Si](C)(C)C(C)(C)C)CCC3.
What is the InChIKey of tert-butyl-dimethyl-[(7-methyl-2,3-dihydro-1H-pyrrolo[1,2-a]indol-8-yl)oxy]silane?
The InChIKey is CDNZXRZPTAMDDL-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H27NOSi/c1-13-9-10-14-12-15-8-7-11-19(15)16(14)17(13)20-21(5,6)18(2,3)4/h9-10,12H,7-8,11H2,1-6H3.
What are the key properties of tert-butyl-dimethyl-[(7-methyl-2,3-dihydro-1H-pyrrolo[1,2-a]indol-8-yl)oxy]silane?
tert-butyl-dimethyl-[(7-methyl-2,3-dihydro-1H-pyrrolo[1,2-a]indol-8-yl)oxy]silane has a molecular weight of 301.51 g/mol, XLogP of 5.28, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-dimethyl-[(7-methyl-2,3-dihydro-1H-pyrrolo[1,2-a]indol-8-yl)oxy]silane is sourced from PubChem (CID 71467272), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).