(6R)-1-[(1R)-2-[tert-butyl(dimethyl)silyl]oxy-1-phenylethyl]-6-methylpiperidin-2-one

C20H33NO2Si — CID 15923317

IUPAC(6R)-1-[(1R)-2-[tert-butyl(dimethyl)silyl]oxy-1-phenylethyl]-6-methylpiperidin-2-one
SMILESC[C@@H]1CCCC(=O)N1[C@@H](CO[Si](C)(C)C(C)(C)C)c1ccccc1
InChIInChI=1S/C20H33NO2Si/c1-16-11-10-14-19(22)21(16)18(17-12-8-7-9-13-17)15-23-24(5,6)20(2,3)4/h7-9,12-13,16,18H,10-11,14-15H2,1-6H3/t16-,18+/m1/s1
InChIKeyDOHFFMZLTBFQHW-AEFFLSMTSA-N
MW347.57 g/mol
LogP5.15
Rot. Bonds5

About (6R)-1-[(1R)-2-[tert-butyl(dimethyl)silyl]oxy-1-phenylethyl]-6-methylpiperidin-2-one

(6R)-1-[(1R)-2-[tert-butyl(dimethyl)silyl]oxy-1-phenylethyl]-6-methylpiperidin-2-one (PubChem CID 15923317) has the molecular formula C20H33NO2Si and a molecular weight of 347.57 g/mol. Its IUPAC name is (6R)-1-[(1R)-2-[tert-butyl(dimethyl)silyl]oxy-1-phenylethyl]-6-methylpiperidin-2-one.

Molecular Properties

Compound Name(6R)-1-[(1R)-2-[tert-butyl(dimethyl)silyl]oxy-1-phenylethyl]-6-methylpiperidin-2-one
PubChem CID15923317
Molecular FormulaC20H33NO2Si
Molecular Weight347.57 g/mol
Exact Mass347.23
IUPAC Name(6R)-1-[(1R)-2-[tert-butyl(dimethyl)silyl]oxy-1-phenylethyl]-6-methylpiperidin-2-one
SMILESC[C@@H]1CCCC(=O)N1[C@@H](CO[Si](C)(C)C(C)(C)C)c1ccccc1
InChIInChI=1S/C20H33NO2Si/c1-16-11-10-14-19(22)21(16)18(17-12-8-7-9-13-17)15-23-24(5,6)20(2,3)4/h7-9,12-13,16,18H,10-11,14-15H2,1-6H3/t16-,18+/m1/s1
InChIKeyDOHFFMZLTBFQHW-AEFFLSMTSA-N
XLogP5.15
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500347.57
LogP ≤ 55.15
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze (6R)-1-[(1R)-2-[tert-butyl(dimethyl)silyl]oxy-1-phenylethyl]-6-methylpiperidin-2-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of (6R)-1-[(1R)-2-[tert-butyl(dimethyl)silyl]oxy-1-phenylethyl]-6-methylpiperidin-2-one?
The IUPAC name of (6R)-1-[(1R)-2-[tert-butyl(dimethyl)silyl]oxy-1-phenylethyl]-6-methylpiperidin-2-one (CID 15923317) is (6R)-1-[(1R)-2-[tert-butyl(dimethyl)silyl]oxy-1-phenylethyl]-6-methylpiperidin-2-one.
What is the SMILES notation for (6R)-1-[(1R)-2-[tert-butyl(dimethyl)silyl]oxy-1-phenylethyl]-6-methylpiperidin-2-one?
The canonical SMILES for (6R)-1-[(1R)-2-[tert-butyl(dimethyl)silyl]oxy-1-phenylethyl]-6-methylpiperidin-2-one is C[C@@H]1CCCC(=O)N1[C@@H](CO[Si](C)(C)C(C)(C)C)c1ccccc1.
What is the InChIKey of (6R)-1-[(1R)-2-[tert-butyl(dimethyl)silyl]oxy-1-phenylethyl]-6-methylpiperidin-2-one?
The InChIKey is DOHFFMZLTBFQHW-AEFFLSMTSA-N. The full InChI is InChI=1S/C20H33NO2Si/c1-16-11-10-14-19(22)21(16)18(17-12-8-7-9-13-17)15-23-24(5,6)20(2,3)4/h7-9,12-13,16,18H,10-11,14-15H2,1-6H3/t16-,18+/m1/s1.
What are the key properties of (6R)-1-[(1R)-2-[tert-butyl(dimethyl)silyl]oxy-1-phenylethyl]-6-methylpiperidin-2-one?
(6R)-1-[(1R)-2-[tert-butyl(dimethyl)silyl]oxy-1-phenylethyl]-6-methylpiperidin-2-one has a molecular weight of 347.57 g/mol, XLogP of 5.15, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (6R)-1-[(1R)-2-[tert-butyl(dimethyl)silyl]oxy-1-phenylethyl]-6-methylpiperidin-2-one is sourced from PubChem (CID 15923317), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).