tert-butyl-dimethyl-[(4-methyl-2,3-dihydro-1H-pyrrol-2-yl)methoxy]silane

C12H25NOSi — CID 141417335

IUPACtert-butyl-dimethyl-[(4-methyl-2,3-dihydro-1H-pyrrol-2-yl)methoxy]silane
SMILESCC1=CNC(CO[Si](C)(C)C(C)(C)C)C1
InChIInChI=1S/C12H25NOSi/c1-10-7-11(13-8-10)9-14-15(5,6)12(2,3)4/h8,11,13H,7,9H2,1-6H3
InChIKeyDRKCNTJQOZOZKP-UHFFFAOYSA-N
MW227.42 g/mol
LogP3.27
Rot. Bonds3

About tert-butyl-dimethyl-[(4-methyl-2,3-dihydro-1H-pyrrol-2-yl)methoxy]silane

tert-butyl-dimethyl-[(4-methyl-2,3-dihydro-1H-pyrrol-2-yl)methoxy]silane (PubChem CID 141417335) has the molecular formula C12H25NOSi and a molecular weight of 227.42 g/mol. Its IUPAC name is tert-butyl-dimethyl-[(4-methyl-2,3-dihydro-1H-pyrrol-2-yl)methoxy]silane.

Molecular Properties

Compound Nametert-butyl-dimethyl-[(4-methyl-2,3-dihydro-1H-pyrrol-2-yl)methoxy]silane
PubChem CID141417335
Molecular FormulaC12H25NOSi
Molecular Weight227.42 g/mol
Exact Mass227.17
IUPAC Nametert-butyl-dimethyl-[(4-methyl-2,3-dihydro-1H-pyrrol-2-yl)methoxy]silane
SMILESCC1=CNC(CO[Si](C)(C)C(C)(C)C)C1
InChIInChI=1S/C12H25NOSi/c1-10-7-11(13-8-10)9-14-15(5,6)12(2,3)4/h8,11,13H,7,9H2,1-6H3
InChIKeyDRKCNTJQOZOZKP-UHFFFAOYSA-N
XLogP3.27
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.42
LogP ≤ 53.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

Tert-butyl-dimethyl-[(4-methylidenepyrrolidin-2-yl)methoxy]silane
CID 22046628
(2S)-2-[[[(1,1-Dimethylethyl)dimethylsilyl]oxy]methyl]-4-methylenepyrrolidine
CID 58400350

Frequently Asked Questions

What is the IUPAC name of tert-butyl-dimethyl-[(4-methyl-2,3-dihydro-1H-pyrrol-2-yl)methoxy]silane?
The IUPAC name of tert-butyl-dimethyl-[(4-methyl-2,3-dihydro-1H-pyrrol-2-yl)methoxy]silane (CID 141417335) is tert-butyl-dimethyl-[(4-methyl-2,3-dihydro-1H-pyrrol-2-yl)methoxy]silane.
What is the SMILES notation for tert-butyl-dimethyl-[(4-methyl-2,3-dihydro-1H-pyrrol-2-yl)methoxy]silane?
The canonical SMILES for tert-butyl-dimethyl-[(4-methyl-2,3-dihydro-1H-pyrrol-2-yl)methoxy]silane is CC1=CNC(CO[Si](C)(C)C(C)(C)C)C1.
What is the InChIKey of tert-butyl-dimethyl-[(4-methyl-2,3-dihydro-1H-pyrrol-2-yl)methoxy]silane?
The InChIKey is DRKCNTJQOZOZKP-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H25NOSi/c1-10-7-11(13-8-10)9-14-15(5,6)12(2,3)4/h8,11,13H,7,9H2,1-6H3.
What are the key properties of tert-butyl-dimethyl-[(4-methyl-2,3-dihydro-1H-pyrrol-2-yl)methoxy]silane?
tert-butyl-dimethyl-[(4-methyl-2,3-dihydro-1H-pyrrol-2-yl)methoxy]silane has a molecular weight of 227.42 g/mol, XLogP of 3.27, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-dimethyl-[(4-methyl-2,3-dihydro-1H-pyrrol-2-yl)methoxy]silane is sourced from PubChem (CID 141417335), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).