5-pentadec-1-enyl-4-[tri(propan-2-yl)silyloxymethyl]-1,3-oxazolidin-2-one

C28H55NO3Si — CID 73072594

IUPAC5-pentadec-1-enyl-4-[tri(propan-2-yl)silyloxymethyl]-1,3-oxazolidin-2-one
SMILESCCCCCCCCCCCCCC=CC1OC(=O)NC1CO[Si](C(C)C)(C(C)C)C(C)C
InChIInChI=1S/C28H55NO3Si/c1-8-9-10-11-12-13-14-15-16-17-18-19-20-21-27-26(29-28(30)32-27)22-31-33(23(2)3,24(4)5)25(6)7/h20-21,23-27H,8-19,22H2,1-7H3,(H,29,30)
InChIKeyKCPSECPXIHBDLX-UHFFFAOYSA-N
MW481.84 g/mol
LogP8.91
Rot. Bonds19

About 5-pentadec-1-enyl-4-[tri(propan-2-yl)silyloxymethyl]-1,3-oxazolidin-2-one

5-pentadec-1-enyl-4-[tri(propan-2-yl)silyloxymethyl]-1,3-oxazolidin-2-one (PubChem CID 73072594) has the molecular formula C28H55NO3Si and a molecular weight of 481.84 g/mol. Its IUPAC name is 5-pentadec-1-enyl-4-[tri(propan-2-yl)silyloxymethyl]-1,3-oxazolidin-2-one.

Molecular Properties

Compound Name5-pentadec-1-enyl-4-[tri(propan-2-yl)silyloxymethyl]-1,3-oxazolidin-2-one
PubChem CID73072594
Molecular FormulaC28H55NO3Si
Molecular Weight481.84 g/mol
Exact Mass481.40
IUPAC Name5-pentadec-1-enyl-4-[tri(propan-2-yl)silyloxymethyl]-1,3-oxazolidin-2-one
SMILESCCCCCCCCCCCCCC=CC1OC(=O)NC1CO[Si](C(C)C)(C(C)C)C(C)C
InChIInChI=1S/C28H55NO3Si/c1-8-9-10-11-12-13-14-15-16-17-18-19-20-21-27-26(29-28(30)32-27)22-31-33(23(2)3,24(4)5)25(6)7/h20-21,23-27H,8-19,22H2,1-7H3,(H,29,30)
InChIKeyKCPSECPXIHBDLX-UHFFFAOYSA-N
XLogP8.91
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds19
Heavy Atoms33
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500481.84
LogP ≤ 58.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze 5-pentadec-1-enyl-4-[tri(propan-2-yl)silyloxymethyl]-1,3-oxazolidin-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 5-pentadec-1-enyl-4-[tri(propan-2-yl)silyloxymethyl]-1,3-oxazolidin-2-one?
The IUPAC name of 5-pentadec-1-enyl-4-[tri(propan-2-yl)silyloxymethyl]-1,3-oxazolidin-2-one (CID 73072594) is 5-pentadec-1-enyl-4-[tri(propan-2-yl)silyloxymethyl]-1,3-oxazolidin-2-one.
What is the SMILES notation for 5-pentadec-1-enyl-4-[tri(propan-2-yl)silyloxymethyl]-1,3-oxazolidin-2-one?
The canonical SMILES for 5-pentadec-1-enyl-4-[tri(propan-2-yl)silyloxymethyl]-1,3-oxazolidin-2-one is CCCCCCCCCCCCCC=CC1OC(=O)NC1CO[Si](C(C)C)(C(C)C)C(C)C.
What is the InChIKey of 5-pentadec-1-enyl-4-[tri(propan-2-yl)silyloxymethyl]-1,3-oxazolidin-2-one?
The InChIKey is KCPSECPXIHBDLX-UHFFFAOYSA-N. The full InChI is InChI=1S/C28H55NO3Si/c1-8-9-10-11-12-13-14-15-16-17-18-19-20-21-27-26(29-28(30)32-27)22-31-33(23(2)3,24(4)5)25(6)7/h20-21,23-27H,8-19,22H2,1-7H3,(H,29,30).
What are the key properties of 5-pentadec-1-enyl-4-[tri(propan-2-yl)silyloxymethyl]-1,3-oxazolidin-2-one?
5-pentadec-1-enyl-4-[tri(propan-2-yl)silyloxymethyl]-1,3-oxazolidin-2-one has a molecular weight of 481.84 g/mol, XLogP of 8.91, 19 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-pentadec-1-enyl-4-[tri(propan-2-yl)silyloxymethyl]-1,3-oxazolidin-2-one is sourced from PubChem (CID 73072594), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).