[4-(5-butan-2-yl-4-methyl-2-pyridinyl)dibenzofuran-1-yl]-trimethylsilane

C25H29NOSi — CID 164797005

IUPAC[4-(5-butan-2-yl-4-methyl-2-pyridinyl)dibenzofuran-1-yl]-trimethylsilane
SMILESCCC(C)c1cnc(-c2ccc([Si](C)(C)C)c3c2oc2ccccc23)cc1C
InChIInChI=1S/C25H29NOSi/c1-7-16(2)20-15-26-21(14-17(20)3)18-12-13-23(28(4,5)6)24-19-10-8-9-11-22(19)27-25(18)24/h8-16H,7H2,1-6H3
InChIKeyGSBJPJJYIIBEJH-UHFFFAOYSA-N
MW387.60 g/mol
LogP7.02
Rot. Bonds4

About [4-(5-butan-2-yl-4-methyl-2-pyridinyl)dibenzofuran-1-yl]-trimethylsilane

[4-(5-butan-2-yl-4-methyl-2-pyridinyl)dibenzofuran-1-yl]-trimethylsilane (PubChem CID 164797005) has the molecular formula C25H29NOSi and a molecular weight of 387.60 g/mol. Its IUPAC name is [4-(5-butan-2-yl-4-methyl-2-pyridinyl)dibenzofuran-1-yl]-trimethylsilane.

Molecular Properties

Compound Name[4-(5-butan-2-yl-4-methyl-2-pyridinyl)dibenzofuran-1-yl]-trimethylsilane
PubChem CID164797005
Molecular FormulaC25H29NOSi
Molecular Weight387.60 g/mol
Exact Mass387.20
IUPAC Name[4-(5-butan-2-yl-4-methyl-2-pyridinyl)dibenzofuran-1-yl]-trimethylsilane
SMILESCCC(C)c1cnc(-c2ccc([Si](C)(C)C)c3c2oc2ccccc23)cc1C
InChIInChI=1S/C25H29NOSi/c1-7-16(2)20-15-26-21(14-17(20)3)18-12-13-23(28(4,5)6)24-19-10-8-9-11-22(19)27-25(18)24/h8-16H,7H2,1-6H3
InChIKeyGSBJPJJYIIBEJH-UHFFFAOYSA-N
XLogP7.02
TPSA26.03 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500387.60
LogP ≤ 57.02
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

[4-(4-butan-2-yl-5-methyl-2-pyridinyl)dibenzofuran-1-yl]-trimethylsilane
CID 164796829
trimethyl-[4-(5-propan-2-yl-2-pyridinyl)dibenzofuran-1-yl]silane
CID 155608517
2-(1-butan-2-yldibenzofuran-4-yl)pyridine
CID 171576764
5-methyl-2-(1-methyldibenzofuran-4-yl)pyridine
CID 156686733
2-[1-(1-deuterio-1-phenylethyl)dibenzofuran-4-yl]-5-phenyl-4-(trideuteriomethyl)pyridine
CID 162709912
[6-(1-carbazol-9-yldibenzofuran-4-yl)-4-(2-methylpropyl)-3-pyridinyl]-trimethylsilane
CID 163214388
5-methyl-4-(2-methylpropyl)-2-[1-(2-phenylpropan-2-yl)dibenzofuran-4-yl]pyridine
CID 162708849
4-[(2S)-butan-2-yl]dibenzofuran
CID 142504734
4-methyl-2-(1-methyldibenzofuran-4-yl)pyridine
CID 171576824
trimethyl-[8-(5-methyl-2-pyridinyl)-[1]benzofuro[2,3-c]pyridin-5-yl]silane
CID 164797075
iridium;4-methyl-2-phenylpyridine;trimethyl-[4-[4-methyl-5-(2-methylpentan-3-yl)-2-pyridinyl]-3H-dibenzofuran-3-id-1-yl]silane
CID 164796884
trimethyl-[4-[4-(3,3,5,5-tetramethylcyclohexyl)-2-pyridinyl]dibenzofuran-1-yl]silane
CID 164796927

Frequently Asked Questions

What is the IUPAC name of [4-(5-butan-2-yl-4-methyl-2-pyridinyl)dibenzofuran-1-yl]-trimethylsilane?
The IUPAC name of [4-(5-butan-2-yl-4-methyl-2-pyridinyl)dibenzofuran-1-yl]-trimethylsilane (CID 164797005) is [4-(5-butan-2-yl-4-methyl-2-pyridinyl)dibenzofuran-1-yl]-trimethylsilane.
What is the SMILES notation for [4-(5-butan-2-yl-4-methyl-2-pyridinyl)dibenzofuran-1-yl]-trimethylsilane?
The canonical SMILES for [4-(5-butan-2-yl-4-methyl-2-pyridinyl)dibenzofuran-1-yl]-trimethylsilane is CCC(C)c1cnc(-c2ccc([Si](C)(C)C)c3c2oc2ccccc23)cc1C.
What is the InChIKey of [4-(5-butan-2-yl-4-methyl-2-pyridinyl)dibenzofuran-1-yl]-trimethylsilane?
The InChIKey is GSBJPJJYIIBEJH-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H29NOSi/c1-7-16(2)20-15-26-21(14-17(20)3)18-12-13-23(28(4,5)6)24-19-10-8-9-11-22(19)27-25(18)24/h8-16H,7H2,1-6H3.
What are the key properties of [4-(5-butan-2-yl-4-methyl-2-pyridinyl)dibenzofuran-1-yl]-trimethylsilane?
[4-(5-butan-2-yl-4-methyl-2-pyridinyl)dibenzofuran-1-yl]-trimethylsilane has a molecular weight of 387.60 g/mol, XLogP of 7.02, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(5-butan-2-yl-4-methyl-2-pyridinyl)dibenzofuran-1-yl]-trimethylsilane is sourced from PubChem (CID 164797005), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).