dimethyl-[4-(2-methyl-3-piperidin-1-ylpropyl)phenyl]-phenylsilane

C23H33NSi — CID 13292194

IUPACdimethyl-[4-(2-methyl-3-piperidin-1-ylpropyl)phenyl]-phenylsilane
SMILESCC(Cc1ccc([Si](C)(C)c2ccccc2)cc1)CN1CCCCC1
InChIInChI=1S/C23H33NSi/c1-20(19-24-16-8-5-9-17-24)18-21-12-14-23(15-13-21)25(2,3)22-10-6-4-7-11-22/h4,6-7,10-15,20H,5,8-9,16-19H2,1-3H3
InChIKeyVSLOBHCLYQERSR-UHFFFAOYSA-N
MW351.61 g/mol
LogP4.17
Rot. Bonds6

About dimethyl-[4-(2-methyl-3-piperidin-1-ylpropyl)phenyl]-phenylsilane

dimethyl-[4-(2-methyl-3-piperidin-1-ylpropyl)phenyl]-phenylsilane (PubChem CID 13292194) has the molecular formula C23H33NSi and a molecular weight of 351.61 g/mol. Its IUPAC name is dimethyl-[4-(2-methyl-3-piperidin-1-ylpropyl)phenyl]-phenylsilane.

Molecular Properties

Compound Namedimethyl-[4-(2-methyl-3-piperidin-1-ylpropyl)phenyl]-phenylsilane
PubChem CID13292194
Molecular FormulaC23H33NSi
Molecular Weight351.61 g/mol
Exact Mass351.24
IUPAC Namedimethyl-[4-(2-methyl-3-piperidin-1-ylpropyl)phenyl]-phenylsilane
SMILESCC(Cc1ccc([Si](C)(C)c2ccccc2)cc1)CN1CCCCC1
InChIInChI=1S/C23H33NSi/c1-20(19-24-16-8-5-9-17-24)18-21-12-14-23(15-13-21)25(2,3)22-10-6-4-7-11-22/h4,6-7,10-15,20H,5,8-9,16-19H2,1-3H3
InChIKeyVSLOBHCLYQERSR-UHFFFAOYSA-N
XLogP4.17
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms25
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500351.61
LogP ≤ 54.17
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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 dimethyl-[4-(2-methyl-3-piperidin-1-ylpropyl)phenyl]-phenylsilane?
The IUPAC name of dimethyl-[4-(2-methyl-3-piperidin-1-ylpropyl)phenyl]-phenylsilane (CID 13292194) is dimethyl-[4-(2-methyl-3-piperidin-1-ylpropyl)phenyl]-phenylsilane.
What is the SMILES notation for dimethyl-[4-(2-methyl-3-piperidin-1-ylpropyl)phenyl]-phenylsilane?
The canonical SMILES for dimethyl-[4-(2-methyl-3-piperidin-1-ylpropyl)phenyl]-phenylsilane is CC(Cc1ccc([Si](C)(C)c2ccccc2)cc1)CN1CCCCC1.
What is the InChIKey of dimethyl-[4-(2-methyl-3-piperidin-1-ylpropyl)phenyl]-phenylsilane?
The InChIKey is VSLOBHCLYQERSR-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H33NSi/c1-20(19-24-16-8-5-9-17-24)18-21-12-14-23(15-13-21)25(2,3)22-10-6-4-7-11-22/h4,6-7,10-15,20H,5,8-9,16-19H2,1-3H3.
What are the key properties of dimethyl-[4-(2-methyl-3-piperidin-1-ylpropyl)phenyl]-phenylsilane?
dimethyl-[4-(2-methyl-3-piperidin-1-ylpropyl)phenyl]-phenylsilane has a molecular weight of 351.61 g/mol, XLogP of 4.17, 6 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for dimethyl-[4-(2-methyl-3-piperidin-1-ylpropyl)phenyl]-phenylsilane is sourced from PubChem (CID 13292194), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).