bis(pyrrolo[2,3-b]pyridin-1-yl)methyl-trimethylsilane

C18H20N4Si — CID 101462972

IUPACbis(pyrrolo[2,3-b]pyridin-1-yl)methyl-trimethylsilane
SMILESC[Si](C)(C)C(n1ccc2cccnc21)n1ccc2cccnc21
InChIInChI=1S/C18H20N4Si/c1-23(2,3)18(21-12-8-14-6-4-10-19-16(14)21)22-13-9-15-7-5-11-20-17(15)22/h4-13,18H,1-3H3
InChIKeyWDVASYAWSTXHBR-UHFFFAOYSA-N
MW320.47 g/mol
LogP4.31
Rot. Bonds3

About bis(pyrrolo[2,3-b]pyridin-1-yl)methyl-trimethylsilane

bis(pyrrolo[2,3-b]pyridin-1-yl)methyl-trimethylsilane (PubChem CID 101462972) has the molecular formula C18H20N4Si and a molecular weight of 320.47 g/mol. Its IUPAC name is bis(pyrrolo[2,3-b]pyridin-1-yl)methyl-trimethylsilane.

Molecular Properties

Compound Namebis(pyrrolo[2,3-b]pyridin-1-yl)methyl-trimethylsilane
PubChem CID101462972
Molecular FormulaC18H20N4Si
Molecular Weight320.47 g/mol
Exact Mass320.15
IUPAC Namebis(pyrrolo[2,3-b]pyridin-1-yl)methyl-trimethylsilane
SMILESC[Si](C)(C)C(n1ccc2cccnc21)n1ccc2cccnc21
InChIInChI=1S/C18H20N4Si/c1-23(2,3)18(21-12-8-14-6-4-10-19-16(14)21)22-13-9-15-7-5-11-20-17(15)22/h4-13,18H,1-3H3
InChIKeyWDVASYAWSTXHBR-UHFFFAOYSA-N
XLogP4.31
TPSA35.64 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.47
LogP ≤ 54.31
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

6-[3-(2,2-Difluoroethyl)-5-(6-methylpyridin-2-yl)imidazol-4-yl]imidazo[1,2-a]pyridine
CID 135233366
1,2-Bis(7-methyl-[1,2,4]triazolo[4,3-a]pyridin-3-yl)ethane
CID 327606
US10399985, Example 25
CID 118278077
2-(tert-butyl)-1-(3-fluorobenzyl)-1H-pyrrolo[2,3-b]pyridine
CID 1488065
7-(pyridin-2-yl)-N-m-tolyl-7H-pyrrolo[2,3-d]pyrimidin-2-amine
CID 11185701
N-(2-ethylphenyl)-7-(pyridin-2-yl)-7H-pyrrolo[2,3-d]pyrimidin-2-amine
CID 11209256
7-(pyridin-2-yl)-N-o-tolyl-7H-pyrrolo[2,3-d]pyrimidin-2-amine
CID 11392449
6-benzyl-7-neopentyl-7H-pyrrolo[2,3-d]pyrimidine-2-carbonitrile
CID 44444203
6-(4-Methylpiperazin-1-yl)pyrrolo[2,3-b]pyridine-1-carboxamide
CID 76317441
6-Pyrrolidin-1-ylpyrrolo[2,3-b]pyridine-1-carboxamide
CID 76335636
N-(6-(1H-Imidazol-1-yl)pyridin-3-yl)-3-(cyclopropylmethyl)-7-methyl-3H-imidazo[4,5-b]pyridin-5-amine
CID 118278495
3-(cyclopropylmethyl)-N-(5-imidazol-1-yl-2-pyridinyl)-7-methylimidazo[4,5-b]pyridin-5-amine
CID 118278501

Frequently Asked Questions

What is the IUPAC name of bis(pyrrolo[2,3-b]pyridin-1-yl)methyl-trimethylsilane?
The IUPAC name of bis(pyrrolo[2,3-b]pyridin-1-yl)methyl-trimethylsilane (CID 101462972) is bis(pyrrolo[2,3-b]pyridin-1-yl)methyl-trimethylsilane.
What is the SMILES notation for bis(pyrrolo[2,3-b]pyridin-1-yl)methyl-trimethylsilane?
The canonical SMILES for bis(pyrrolo[2,3-b]pyridin-1-yl)methyl-trimethylsilane is C[Si](C)(C)C(n1ccc2cccnc21)n1ccc2cccnc21.
What is the InChIKey of bis(pyrrolo[2,3-b]pyridin-1-yl)methyl-trimethylsilane?
The InChIKey is WDVASYAWSTXHBR-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20N4Si/c1-23(2,3)18(21-12-8-14-6-4-10-19-16(14)21)22-13-9-15-7-5-11-20-17(15)22/h4-13,18H,1-3H3.
What are the key properties of bis(pyrrolo[2,3-b]pyridin-1-yl)methyl-trimethylsilane?
bis(pyrrolo[2,3-b]pyridin-1-yl)methyl-trimethylsilane has a molecular weight of 320.47 g/mol, XLogP of 4.31, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for bis(pyrrolo[2,3-b]pyridin-1-yl)methyl-trimethylsilane is sourced from PubChem (CID 101462972), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).