2-[[3-bromo-6-(1-methyltetrazol-5-yl)pyrrolo[2,3-b]pyridin-1-yl]methoxy]ethyl-trimethylsilane;trimethyl-[2-[[6-(1-methyltetrazol-5-yl)pyrrolo[2,3-b]pyridin-1-yl]methoxy]ethyl]silane

C30H43BrN12O2Si2 — CID 163619183

IUPAC2-[[3-bromo-6-(1-methyltetrazol-5-yl)pyrrolo[2,3-b]pyridin-1-yl]methoxy]ethyl-trimethylsilane;trimethyl-[2-[[6-(1-methyltetrazol-5-yl)pyrrolo[2,3-b]pyridin-1-yl]methoxy]ethyl]silane
SMILESCn1nnnc1-c1ccc2c(Br)cn(COCC[Si](C)(C)C)c2n1.Cn1nnnc1-c1ccc2ccn(COCC[Si](C)(C)C)c2n1
InChIInChI=1S/C15H21BrN6OSi.C15H22N6OSi/c1-21-15(18-19-20-21)13-6-5-11-12(16)9-22(14(11)17-13)10-23-7-8-24(2,3)4;1-20-15(17-18-19-20)13-6-5-12-7-8-21(14(12)16-13)11-22-9-10-23(2,3)4/h5-6,9H,7-8,10H2,1-4H3;5-8H,9-11H2,1-4H3
InChIKeyHMQFQHUHAXLDRD-UHFFFAOYSA-N
MW739.83 g/mol
LogP5.84
Rot. Bonds12

About 2-[[3-bromo-6-(1-methyltetrazol-5-yl)pyrrolo[2,3-b]pyridin-1-yl]methoxy]ethyl-trimethylsilane;trimethyl-[2-[[6-(1-methyltetrazol-5-yl)pyrrolo[2,3-b]pyridin-1-yl]methoxy]ethyl]silane

2-[[3-bromo-6-(1-methyltetrazol-5-yl)pyrrolo[2,3-b]pyridin-1-yl]methoxy]ethyl-trimethylsilane;trimethyl-[2-[[6-(1-methyltetrazol-5-yl)pyrrolo[2,3-b]pyridin-1-yl]methoxy]ethyl]silane (PubChem CID 163619183) has the molecular formula C30H43BrN12O2Si2 and a molecular weight of 739.83 g/mol. Its IUPAC name is 2-[[3-bromo-6-(1-methyltetrazol-5-yl)pyrrolo[2,3-b]pyridin-1-yl]methoxy]ethyl-trimethylsilane;trimethyl-[2-[[6-(1-methyltetrazol-5-yl)pyrrolo[2,3-b]pyridin-1-yl]methoxy]ethyl]silane.

Molecular Properties

Compound Name2-[[3-bromo-6-(1-methyltetrazol-5-yl)pyrrolo[2,3-b]pyridin-1-yl]methoxy]ethyl-trimethylsilane;trimethyl-[2-[[6-(1-methyltetrazol-5-yl)pyrrolo[2,3-b]pyridin-1-yl]methoxy]ethyl]silane
PubChem CID163619183
Molecular FormulaC30H43BrN12O2Si2
Molecular Weight739.83 g/mol
Exact Mass738.24
IUPAC Name2-[[3-bromo-6-(1-methyltetrazol-5-yl)pyrrolo[2,3-b]pyridin-1-yl]methoxy]ethyl-trimethylsilane;trimethyl-[2-[[6-(1-methyltetrazol-5-yl)pyrrolo[2,3-b]pyridin-1-yl]methoxy]ethyl]silane
SMILESCn1nnnc1-c1ccc2c(Br)cn(COCC[Si](C)(C)C)c2n1.Cn1nnnc1-c1ccc2ccn(COCC[Si](C)(C)C)c2n1
InChIInChI=1S/C15H21BrN6OSi.C15H22N6OSi/c1-21-15(18-19-20-21)13-6-5-11-12(16)9-22(14(11)17-13)10-23-7-8-24(2,3)4;1-20-15(17-18-19-20)13-6-5-12-7-8-21(14(12)16-13)11-22-9-10-23(2,3)4/h5-6,9H,7-8,10H2,1-4H3;5-8H,9-11H2,1-4H3
InChIKeyHMQFQHUHAXLDRD-UHFFFAOYSA-N
XLogP5.84
TPSA141.30 Ų
H-Bond Donors
H-Bond Acceptors14
Rotatable Bonds12
Heavy Atoms47
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 500739.83
LogP ≤ 55.84
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1014

Computed Properties (RDKit)

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

Analyze 2-[[3-bromo-6-(1-methyltetrazol-5-yl)pyrrolo[2,3-b]pyridin-1-yl]methoxy]ethyl-trimethylsilane;trimethyl-[2-[[6-(1-methyltetrazol-5-yl)pyrrolo[2,3-b]pyridin-1-yl]methoxy]ethyl]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

(3S)-3-[(3S)-1-(6-bromo-3-fluoro-2-pyridinyl)pyrrolidin-3-yl]-3-[4-[7-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-d]pyrimidin-4-yl]pyrazol-1-yl]propanenitrile
CID 87167694
3-(5-bromopyridin-3-yl)-3-[4-(7-[2-(trimethylsilyl)ethoxy]methyl-7H-pyrrolo[2,3-d]pyrimidin-4-yl)-1H-pyrazol-1-yl]propanenitrile
CID 57477881
4-{1-[1-(3-bromophenyl)but-3-en-1-yl]-1H-pyrazol-4-yl}-7-[2-(trimethylsilyl)ethoxy]methyl-7H-pyrrolo[2,3-d]pyrimidine
CID 57480688
rac-tert-butyl (3R,4R)-4-methyl-3-[8-bromo-6-{[2-(trimethylsilyl)ethoxy]methyl}dipyrrolo[2,3-b:2',3'-d]pyridin-1(6H)-yl]piperidine-1-carboxylate
CID 58078503
rac-3-bromo-1-[(3R,4R)-4-methylpiperidin-3-yl]-6-{[2-(trimethylsilyl)ethoxy]methyl}-1,6-dihydrodipyrrolo[2,3-b:2',3'-d]pyridine
CID 58078613
rac-tert-Butyl (3R,4R)-3-[3-bromo-6-{[2-(trimethylsilyl)ethoxy]methyl}dipyrrolo[2,3-b:2',3'-d]pyridin-1(6H)-yl]-4-methylpiperidine-1-carboxylate
CID 58078738
6-Bromo-9-((2-(trimethylsilyl)ethoxy)methyl)-9H-dipyrido[2,3-b;4',3'-d]pyrrole
CID 58364943
4-[5-Bromo-1-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-b]pyridin-3-yl]pyrimidin-2-amine
CID 58395944
5-[3-bromo-1-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-b]pyridin-5-yl]-N,N-dimethylpyridin-2-amine
CID 58758514
2-[[4-(4-Bromo-3-methylpyrazol-1-yl)pyrrolo[2,3-b]pyridin-1-yl]methoxy]ethyl-trimethylsilane
CID 66597689
tert-butyl rac-(3R,4R)-3-[8-bromo-6-{[2-(trimethylsily)ethoxy]methyl}dipyrrolo[2,3-b:2',3'-d]pyridin-1(6H)-yl]-4-methylpiperidine-1-carboxylate
CID 66726478
(3R,4R)-3-[12-bromo-10-(2-trimethylsilylethoxymethyl)-3,8,10-triazatricyclo[7.3.0.02,6]dodeca-1,4,6,8,11-pentaen-3-yl]-4-methylpiperidine-1-carboxylic acid
CID 66726972

Frequently Asked Questions

What is the IUPAC name of 2-[[3-bromo-6-(1-methyltetrazol-5-yl)pyrrolo[2,3-b]pyridin-1-yl]methoxy]ethyl-trimethylsilane;trimethyl-[2-[[6-(1-methyltetrazol-5-yl)pyrrolo[2,3-b]pyridin-1-yl]methoxy]ethyl]silane?
The IUPAC name of 2-[[3-bromo-6-(1-methyltetrazol-5-yl)pyrrolo[2,3-b]pyridin-1-yl]methoxy]ethyl-trimethylsilane;trimethyl-[2-[[6-(1-methyltetrazol-5-yl)pyrrolo[2,3-b]pyridin-1-yl]methoxy]ethyl]silane (CID 163619183) is 2-[[3-bromo-6-(1-methyltetrazol-5-yl)pyrrolo[2,3-b]pyridin-1-yl]methoxy]ethyl-trimethylsilane;trimethyl-[2-[[6-(1-methyltetrazol-5-yl)pyrrolo[2,3-b]pyridin-1-yl]methoxy]ethyl]silane.
What is the SMILES notation for 2-[[3-bromo-6-(1-methyltetrazol-5-yl)pyrrolo[2,3-b]pyridin-1-yl]methoxy]ethyl-trimethylsilane;trimethyl-[2-[[6-(1-methyltetrazol-5-yl)pyrrolo[2,3-b]pyridin-1-yl]methoxy]ethyl]silane?
The canonical SMILES for 2-[[3-bromo-6-(1-methyltetrazol-5-yl)pyrrolo[2,3-b]pyridin-1-yl]methoxy]ethyl-trimethylsilane;trimethyl-[2-[[6-(1-methyltetrazol-5-yl)pyrrolo[2,3-b]pyridin-1-yl]methoxy]ethyl]silane is Cn1nnnc1-c1ccc2c(Br)cn(COCC[Si](C)(C)C)c2n1.Cn1nnnc1-c1ccc2ccn(COCC[Si](C)(C)C)c2n1.
What is the InChIKey of 2-[[3-bromo-6-(1-methyltetrazol-5-yl)pyrrolo[2,3-b]pyridin-1-yl]methoxy]ethyl-trimethylsilane;trimethyl-[2-[[6-(1-methyltetrazol-5-yl)pyrrolo[2,3-b]pyridin-1-yl]methoxy]ethyl]silane?
The InChIKey is HMQFQHUHAXLDRD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21BrN6OSi.C15H22N6OSi/c1-21-15(18-19-20-21)13-6-5-11-12(16)9-22(14(11)17-13)10-23-7-8-24(2,3)4;1-20-15(17-18-19-20)13-6-5-12-7-8-21(14(12)16-13)11-22-9-10-23(2,3)4/h5-6,9H,7-8,10H2,1-4H3;5-8H,9-11H2,1-4H3.
What are the key properties of 2-[[3-bromo-6-(1-methyltetrazol-5-yl)pyrrolo[2,3-b]pyridin-1-yl]methoxy]ethyl-trimethylsilane;trimethyl-[2-[[6-(1-methyltetrazol-5-yl)pyrrolo[2,3-b]pyridin-1-yl]methoxy]ethyl]silane?
2-[[3-bromo-6-(1-methyltetrazol-5-yl)pyrrolo[2,3-b]pyridin-1-yl]methoxy]ethyl-trimethylsilane;trimethyl-[2-[[6-(1-methyltetrazol-5-yl)pyrrolo[2,3-b]pyridin-1-yl]methoxy]ethyl]silane has a molecular weight of 739.83 g/mol, XLogP of 5.84, 12 rotatable bonds, 0 hydrogen bond donors, and 14 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[3-bromo-6-(1-methyltetrazol-5-yl)pyrrolo[2,3-b]pyridin-1-yl]methoxy]ethyl-trimethylsilane;trimethyl-[2-[[6-(1-methyltetrazol-5-yl)pyrrolo[2,3-b]pyridin-1-yl]methoxy]ethyl]silane is sourced from PubChem (CID 163619183), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).