(4-bromo-1H-pyrrolo[2,3-b]pyridin-5-yl)-tri(propan-2-yl)silane

C16H25BrN2Si — CID 123343999

IUPAC(4-bromo-1H-pyrrolo[2,3-b]pyridin-5-yl)-tri(propan-2-yl)silane
SMILESCC(C)[Si](c1cnc2[nH]ccc2c1Br)(C(C)C)C(C)C
InChIInChI=1S/C16H25BrN2Si/c1-10(2)20(11(3)4,12(5)6)14-9-19-16-13(15(14)17)7-8-18-16/h7-12H,1-6H3,(H,18,19)
InChIKeyDXBFHFCATBDGMR-UHFFFAOYSA-N
MW353.38 g/mol
LogP5.21
Rot. Bonds4

About (4-bromo-1H-pyrrolo[2,3-b]pyridin-5-yl)-tri(propan-2-yl)silane

(4-bromo-1H-pyrrolo[2,3-b]pyridin-5-yl)-tri(propan-2-yl)silane (PubChem CID 123343999) has the molecular formula C16H25BrN2Si and a molecular weight of 353.38 g/mol. Its IUPAC name is (4-bromo-1H-pyrrolo[2,3-b]pyridin-5-yl)-tri(propan-2-yl)silane.

Molecular Properties

Compound Name(4-bromo-1H-pyrrolo[2,3-b]pyridin-5-yl)-tri(propan-2-yl)silane
PubChem CID123343999
Molecular FormulaC16H25BrN2Si
Molecular Weight353.38 g/mol
Exact Mass352.10
IUPAC Name(4-bromo-1H-pyrrolo[2,3-b]pyridin-5-yl)-tri(propan-2-yl)silane
SMILESCC(C)[Si](c1cnc2[nH]ccc2c1Br)(C(C)C)C(C)C
InChIInChI=1S/C16H25BrN2Si/c1-10(2)20(11(3)4,12(5)6)14-9-19-16-13(15(14)17)7-8-18-16/h7-12H,1-6H3,(H,18,19)
InChIKeyDXBFHFCATBDGMR-UHFFFAOYSA-N
XLogP5.21
TPSA28.68 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500353.38
LogP ≤ 55.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze (4-bromo-1H-pyrrolo[2,3-b]pyridin-5-yl)-tri(propan-2-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

1H-Pyrrolo(2,3-b)pyridine
CID 9222
Rolodine
CID 5359646
5-Fluoro-1H-pyrrolo[2,3-b]pyridine
CID 20784462
5-bromo-1H-pyrrolo[2,3-b]pyridine
CID 10307932
3-Bromo-1H-pyrrolo[2,3-b]pyridine
CID 5523659
4-Bromo-1H-pyrrolo[2,3-b]pyridine
CID 22273643
6-Bromo-7-azaindole
CID 11159915
N-(3-bromophenyl)-7H-pyrrolo[2,3-d]pyrimidin-4-amine
CID 57045449
6-bromo-2-phenyl-1H-imidazo[4,5-b]pyridine
CID 4789370
(R)-N-(1-(7H-pyrrolo[2,3-d]pyrimidin-4-yl)pyrrolidin-3-yl)-5-bromo-N-methylpyridin-2-amine
CID 66765983
3-(Dimethylaminomethyl)-7-azaindole
CID 5383549
4-methyl-1H-pyrrolo(2,3-b)pyridine
CID 5924298

Frequently Asked Questions

What is the IUPAC name of (4-bromo-1H-pyrrolo[2,3-b]pyridin-5-yl)-tri(propan-2-yl)silane?
The IUPAC name of (4-bromo-1H-pyrrolo[2,3-b]pyridin-5-yl)-tri(propan-2-yl)silane (CID 123343999) is (4-bromo-1H-pyrrolo[2,3-b]pyridin-5-yl)-tri(propan-2-yl)silane.
What is the SMILES notation for (4-bromo-1H-pyrrolo[2,3-b]pyridin-5-yl)-tri(propan-2-yl)silane?
The canonical SMILES for (4-bromo-1H-pyrrolo[2,3-b]pyridin-5-yl)-tri(propan-2-yl)silane is CC(C)[Si](c1cnc2[nH]ccc2c1Br)(C(C)C)C(C)C.
What is the InChIKey of (4-bromo-1H-pyrrolo[2,3-b]pyridin-5-yl)-tri(propan-2-yl)silane?
The InChIKey is DXBFHFCATBDGMR-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25BrN2Si/c1-10(2)20(11(3)4,12(5)6)14-9-19-16-13(15(14)17)7-8-18-16/h7-12H,1-6H3,(H,18,19).
What are the key properties of (4-bromo-1H-pyrrolo[2,3-b]pyridin-5-yl)-tri(propan-2-yl)silane?
(4-bromo-1H-pyrrolo[2,3-b]pyridin-5-yl)-tri(propan-2-yl)silane has a molecular weight of 353.38 g/mol, XLogP of 5.21, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (4-bromo-1H-pyrrolo[2,3-b]pyridin-5-yl)-tri(propan-2-yl)silane is sourced from PubChem (CID 123343999), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).