(2-bromo-6-methyl-4-pyridinyl)methoxy-tert-butyl-dimethylsilane

C13H22BrNOSi — CID 142618982

IUPAC(2-bromo-6-methyl-4-pyridinyl)methoxy-tert-butyl-dimethylsilane
SMILESCc1cc(CO[Si](C)(C)C(C)(C)C)cc(Br)n1
InChIInChI=1S/C13H22BrNOSi/c1-10-7-11(8-12(14)15-10)9-16-17(5,6)13(2,3)4/h7-8H,9H2,1-6H3
InChIKeyXUVBIIPZKDBNCW-UHFFFAOYSA-N
MW316.31 g/mol
LogP4.67
Rot. Bonds3

About (2-bromo-6-methyl-4-pyridinyl)methoxy-tert-butyl-dimethylsilane

(2-bromo-6-methyl-4-pyridinyl)methoxy-tert-butyl-dimethylsilane (PubChem CID 142618982) has the molecular formula C13H22BrNOSi and a molecular weight of 316.31 g/mol. Its IUPAC name is (2-bromo-6-methyl-4-pyridinyl)methoxy-tert-butyl-dimethylsilane.

Molecular Properties

Compound Name(2-bromo-6-methyl-4-pyridinyl)methoxy-tert-butyl-dimethylsilane
PubChem CID142618982
Molecular FormulaC13H22BrNOSi
Molecular Weight316.31 g/mol
Exact Mass315.07
IUPAC Name(2-bromo-6-methyl-4-pyridinyl)methoxy-tert-butyl-dimethylsilane
SMILESCc1cc(CO[Si](C)(C)C(C)(C)C)cc(Br)n1
InChIInChI=1S/C13H22BrNOSi/c1-10-7-11(8-12(14)15-10)9-16-17(5,6)13(2,3)4/h7-8H,9H2,1-6H3
InChIKeyXUVBIIPZKDBNCW-UHFFFAOYSA-N
XLogP4.67
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.31
LogP ≤ 54.67
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}

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Related Compounds

(2-bromo-4-pyridinyl)methoxy-tert-butyl-dimethylsilane
CID 58538627
5-[[tert-butyl(dimethyl)silyl]oxymethyl]benzene-1,3-diamine
CID 71429023
(4-bromophenyl)methoxy-tert-butyl-dimethylsilane
CID 10859583
tert-butyl-dimethyl-[(3,4,5-trifluorophenyl)methoxy]silane
CID 91735449
tert-butyl-dimethyl-[(4-methylphenyl)methoxy]silane
CID 21304531
[4-(bromomethyl)phenyl]methoxy-tert-butyl-dimethylsilane
CID 10757711
tert-butyl-dimethyl-[(3-methylphenyl)methoxy]silane
CID 22967275
bis[4-[[tert-butyl(dimethyl)silyl]oxymethyl]-2,6-dimethylphenyl] carbonate
CID 10325443
2-bromo-4-[[tert-butyl(dimethyl)silyl]oxymethyl]benzaldehyde
CID 171089629
tert-butyl-[(4-tert-butylphenyl)methoxy]-dimethylsilane
CID 101140446
tert-butyl-[(4-ethyl-3-methylphenyl)methoxy]-dimethylsilane
CID 167684834
4-[[tert-butyl(dimethyl)silyl]oxymethyl]-2,6-difluorobenzonitrile
CID 161218423

Frequently Asked Questions

What is the IUPAC name of (2-bromo-6-methyl-4-pyridinyl)methoxy-tert-butyl-dimethylsilane?
The IUPAC name of (2-bromo-6-methyl-4-pyridinyl)methoxy-tert-butyl-dimethylsilane (CID 142618982) is (2-bromo-6-methyl-4-pyridinyl)methoxy-tert-butyl-dimethylsilane.
What is the SMILES notation for (2-bromo-6-methyl-4-pyridinyl)methoxy-tert-butyl-dimethylsilane?
The canonical SMILES for (2-bromo-6-methyl-4-pyridinyl)methoxy-tert-butyl-dimethylsilane is Cc1cc(CO[Si](C)(C)C(C)(C)C)cc(Br)n1.
What is the InChIKey of (2-bromo-6-methyl-4-pyridinyl)methoxy-tert-butyl-dimethylsilane?
The InChIKey is XUVBIIPZKDBNCW-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22BrNOSi/c1-10-7-11(8-12(14)15-10)9-16-17(5,6)13(2,3)4/h7-8H,9H2,1-6H3.
What are the key properties of (2-bromo-6-methyl-4-pyridinyl)methoxy-tert-butyl-dimethylsilane?
(2-bromo-6-methyl-4-pyridinyl)methoxy-tert-butyl-dimethylsilane has a molecular weight of 316.31 g/mol, XLogP of 4.67, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2-bromo-6-methyl-4-pyridinyl)methoxy-tert-butyl-dimethylsilane is sourced from PubChem (CID 142618982), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).