methyl-tris(pyrrolo[2,3-b]pyridin-1-yl)silane

C22H18N6Si — CID 139110626

IUPACmethyl-tris(pyrrolo[2,3-b]pyridin-1-yl)silane
SMILESC[Si](n1ccc2cccnc21)(n1ccc2cccnc21)n1ccc2cccnc21
InChIInChI=1S/C22H18N6Si/c1-29(26-14-8-17-5-2-11-23-20(17)26,27-15-9-18-6-3-12-24-21(18)27)28-16-10-19-7-4-13-25-22(19)28/h2-16H,1H3
InChIKeyOBQWKLMRYKFKHW-UHFFFAOYSA-N
MW394.51 g/mol
LogP4.25
Rot. Bonds3

About methyl-tris(pyrrolo[2,3-b]pyridin-1-yl)silane

methyl-tris(pyrrolo[2,3-b]pyridin-1-yl)silane (PubChem CID 139110626) has the molecular formula C22H18N6Si and a molecular weight of 394.51 g/mol. Its IUPAC name is methyl-tris(pyrrolo[2,3-b]pyridin-1-yl)silane.

Molecular Properties

Compound Namemethyl-tris(pyrrolo[2,3-b]pyridin-1-yl)silane
PubChem CID139110626
Molecular FormulaC22H18N6Si
Molecular Weight394.51 g/mol
Exact Mass394.14
IUPAC Namemethyl-tris(pyrrolo[2,3-b]pyridin-1-yl)silane
SMILESC[Si](n1ccc2cccnc21)(n1ccc2cccnc21)n1ccc2cccnc21
InChIInChI=1S/C22H18N6Si/c1-29(26-14-8-17-5-2-11-23-20(17)26,27-15-9-18-6-3-12-24-21(18)27)28-16-10-19-7-4-13-25-22(19)28/h2-16H,1H3
InChIKeyOBQWKLMRYKFKHW-UHFFFAOYSA-N
XLogP4.25
TPSA53.46 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500394.51
LogP ≤ 54.25
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

Analyze methyl-tris(pyrrolo[2,3-b]pyridin-1-yl)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

methane;1-methylpyrrolo[2,3-b]pyridine
CID 142434166
1-methylpyrrolo[2,3-b]pyridine;propane
CID 144881648
N-ethylpyrrolo[2,3-b]pyridin-1-amine
CID 10419482
trimethyl(2-pyrrolo[2,3-b]pyridin-1-yloxyethyl)silane
CID 153406221
1-phenylpyrrolo[2,3-b]pyridine
CID 18372148
1-piperidin-4-yloxypyrrolo[2,3-b]pyridine
CID 71112397
ethane;1-methylpyrrolo[2,3-b]pyridine;toluene
CID 143220810
1-(2,5-dimethylpyrazol-3-yl)pyrrolo[2,3-b]pyridine
CID 141216183
N-methyl-1-pyrrolo[2,3-b]pyridin-1-ylpropan-2-amine
CID 117223827
1-(3-methoxypropyl)pyrrolo[2,3-b]pyridine
CID 59595069
(2R,4S,5R)-2-(hydroxymethyl)-5-pyrrolo[2,3-b]pyridin-1-yloxolane-3,4-diol
CID 162472621
1-(cyclopropylmethyl)pyrrolo[2,3-b]pyridine
CID 76852301

Frequently Asked Questions

What is the IUPAC name of methyl-tris(pyrrolo[2,3-b]pyridin-1-yl)silane?
The IUPAC name of methyl-tris(pyrrolo[2,3-b]pyridin-1-yl)silane (CID 139110626) is methyl-tris(pyrrolo[2,3-b]pyridin-1-yl)silane.
What is the SMILES notation for methyl-tris(pyrrolo[2,3-b]pyridin-1-yl)silane?
The canonical SMILES for methyl-tris(pyrrolo[2,3-b]pyridin-1-yl)silane is C[Si](n1ccc2cccnc21)(n1ccc2cccnc21)n1ccc2cccnc21.
What is the InChIKey of methyl-tris(pyrrolo[2,3-b]pyridin-1-yl)silane?
The InChIKey is OBQWKLMRYKFKHW-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H18N6Si/c1-29(26-14-8-17-5-2-11-23-20(17)26,27-15-9-18-6-3-12-24-21(18)27)28-16-10-19-7-4-13-25-22(19)28/h2-16H,1H3.
What are the key properties of methyl-tris(pyrrolo[2,3-b]pyridin-1-yl)silane?
methyl-tris(pyrrolo[2,3-b]pyridin-1-yl)silane has a molecular weight of 394.51 g/mol, XLogP of 4.25, 3 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for methyl-tris(pyrrolo[2,3-b]pyridin-1-yl)silane is sourced from PubChem (CID 139110626), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).