2,3-dimethylbutan-2-yl-dimethyl-[(methyl-oxo-phenyl-λ6-sulfanylidene)amino]silane

C15H27NOSSi — CID 134870387

IUPAC2,3-dimethylbutan-2-yl-dimethyl-[(methyl-oxo-phenyl-λ6-sulfanylidene)amino]silane
SMILESCC(C)C(C)(C)[Si](C)(C)N=S(C)(=O)c1ccccc1
InChIInChI=1S/C15H27NOSSi/c1-13(2)15(3,4)19(6,7)16-18(5,17)14-11-9-8-10-12-14/h8-13H,1-7H3
InChIKeyGAGMNSJYQAPEOM-UHFFFAOYSA-N
MW297.54 g/mol
LogP4.78
Rot. Bonds4

About 2,3-dimethylbutan-2-yl-dimethyl-[(methyl-oxo-phenyl-λ6-sulfanylidene)amino]silane

2,3-dimethylbutan-2-yl-dimethyl-[(methyl-oxo-phenyl-λ6-sulfanylidene)amino]silane (PubChem CID 134870387) has the molecular formula C15H27NOSSi and a molecular weight of 297.54 g/mol. Its IUPAC name is 2,3-dimethylbutan-2-yl-dimethyl-[(methyl-oxo-phenyl-λ6-sulfanylidene)amino]silane.

Molecular Properties

Compound Name2,3-dimethylbutan-2-yl-dimethyl-[(methyl-oxo-phenyl-λ6-sulfanylidene)amino]silane
PubChem CID134870387
Molecular FormulaC15H27NOSSi
Molecular Weight297.54 g/mol
Exact Mass297.16
IUPAC Name2,3-dimethylbutan-2-yl-dimethyl-[(methyl-oxo-phenyl-λ6-sulfanylidene)amino]silane
SMILESCC(C)C(C)(C)[Si](C)(C)N=S(C)(=O)c1ccccc1
InChIInChI=1S/C15H27NOSSi/c1-13(2)15(3,4)19(6,7)16-18(5,17)14-11-9-8-10-12-14/h8-13H,1-7H3
InChIKeyGAGMNSJYQAPEOM-UHFFFAOYSA-N
XLogP4.78
TPSA29.43 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.54
LogP ≤ 54.78
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2,3-dimethylbutan-2-yl-dimethyl-[(methyl-oxo-phenyl-λ6-sulfanylidene)amino]silane?
The IUPAC name of 2,3-dimethylbutan-2-yl-dimethyl-[(methyl-oxo-phenyl-λ6-sulfanylidene)amino]silane (CID 134870387) is 2,3-dimethylbutan-2-yl-dimethyl-[(methyl-oxo-phenyl-λ6-sulfanylidene)amino]silane.
What is the SMILES notation for 2,3-dimethylbutan-2-yl-dimethyl-[(methyl-oxo-phenyl-λ6-sulfanylidene)amino]silane?
The canonical SMILES for 2,3-dimethylbutan-2-yl-dimethyl-[(methyl-oxo-phenyl-λ6-sulfanylidene)amino]silane is CC(C)C(C)(C)[Si](C)(C)N=S(C)(=O)c1ccccc1.
What is the InChIKey of 2,3-dimethylbutan-2-yl-dimethyl-[(methyl-oxo-phenyl-λ6-sulfanylidene)amino]silane?
The InChIKey is GAGMNSJYQAPEOM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H27NOSSi/c1-13(2)15(3,4)19(6,7)16-18(5,17)14-11-9-8-10-12-14/h8-13H,1-7H3.
What are the key properties of 2,3-dimethylbutan-2-yl-dimethyl-[(methyl-oxo-phenyl-λ6-sulfanylidene)amino]silane?
2,3-dimethylbutan-2-yl-dimethyl-[(methyl-oxo-phenyl-λ6-sulfanylidene)amino]silane has a molecular weight of 297.54 g/mol, XLogP of 4.78, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dimethylbutan-2-yl-dimethyl-[(methyl-oxo-phenyl-λ6-sulfanylidene)amino]silane is sourced from PubChem (CID 134870387), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).