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

C16H27BrN2Si — CID 157428785

IUPAC5-bromo-1H-pyrrolo[2,3-b]pyridine;tri(propan-2-yl)silane
SMILESBrc1cnc2[nH]ccc2c1.CC(C)[SiH](C(C)C)C(C)C
InChIInChI=1S/C9H22Si.C7H5BrN2/c1-7(2)10(8(3)4)9(5)6;8-6-3-5-1-2-9-7(5)10-4-6/h7-10H,1-6H3;1-4H,(H,9,10)
InChIKeyBQGYMRDNDMXIJU-UHFFFAOYSA-N
MW355.40 g/mol
LogP5.77
Rot. Bonds3

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

5-bromo-1H-pyrrolo[2,3-b]pyridine;tri(propan-2-yl)silane (PubChem CID 157428785) has the molecular formula C16H27BrN2Si and a molecular weight of 355.40 g/mol. Its IUPAC name is 5-bromo-1H-pyrrolo[2,3-b]pyridine;tri(propan-2-yl)silane.

Molecular Properties

Compound Name5-bromo-1H-pyrrolo[2,3-b]pyridine;tri(propan-2-yl)silane
PubChem CID157428785
Molecular FormulaC16H27BrN2Si
Molecular Weight355.40 g/mol
Exact Mass354.11
IUPAC Name5-bromo-1H-pyrrolo[2,3-b]pyridine;tri(propan-2-yl)silane
SMILESBrc1cnc2[nH]ccc2c1.CC(C)[SiH](C(C)C)C(C)C
InChIInChI=1S/C9H22Si.C7H5BrN2/c1-7(2)10(8(3)4)9(5)6;8-6-3-5-1-2-9-7(5)10-4-6/h7-10H,1-6H3;1-4H,(H,9,10)
InChIKeyBQGYMRDNDMXIJU-UHFFFAOYSA-N
XLogP5.77
TPSA28.68 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500355.40
LogP ≤ 55.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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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 5-bromo-1H-pyrrolo[2,3-b]pyridine;tri(propan-2-yl)silane?
The IUPAC name of 5-bromo-1H-pyrrolo[2,3-b]pyridine;tri(propan-2-yl)silane (CID 157428785) is 5-bromo-1H-pyrrolo[2,3-b]pyridine;tri(propan-2-yl)silane.
What is the SMILES notation for 5-bromo-1H-pyrrolo[2,3-b]pyridine;tri(propan-2-yl)silane?
The canonical SMILES for 5-bromo-1H-pyrrolo[2,3-b]pyridine;tri(propan-2-yl)silane is Brc1cnc2[nH]ccc2c1.CC(C)[SiH](C(C)C)C(C)C.
What is the InChIKey of 5-bromo-1H-pyrrolo[2,3-b]pyridine;tri(propan-2-yl)silane?
The InChIKey is BQGYMRDNDMXIJU-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H22Si.C7H5BrN2/c1-7(2)10(8(3)4)9(5)6;8-6-3-5-1-2-9-7(5)10-4-6/h7-10H,1-6H3;1-4H,(H,9,10).
What are the key properties of 5-bromo-1H-pyrrolo[2,3-b]pyridine;tri(propan-2-yl)silane?
5-bromo-1H-pyrrolo[2,3-b]pyridine;tri(propan-2-yl)silane has a molecular weight of 355.40 g/mol, XLogP of 5.77, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-1H-pyrrolo[2,3-b]pyridine;tri(propan-2-yl)silane is sourced from PubChem (CID 157428785), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).