CID 155769912

C14H20NO3Si — CID 155769912

IUPAC—
SMILESCCC(C)(C)OC(=O)N(C)c1ccc(OC[Si])cc1
InChIInChI=1S/C14H20NO3Si/c1-5-14(2,3)18-13(16)15(4)11-6-8-12(9-7-11)17-10-19/h6-9H,5,10H2,1-4H3
InChIKeyUYDJYRJXIIEEKK-UHFFFAOYSA-N
MW278.40 g/mol
LogP2.95
Rot. Bonds5

About CID 155769912

CID 155769912 (PubChem CID 155769912) has the molecular formula C14H20NO3Si and a molecular weight of 278.40 g/mol.

Molecular Properties

Compound NameCID 155769912
PubChem CID155769912
Molecular FormulaC14H20NO3Si
Molecular Weight278.40 g/mol
Exact Mass278.12
IUPAC Name—
SMILESCCC(C)(C)OC(=O)N(C)c1ccc(OC[Si])cc1
InChIInChI=1S/C14H20NO3Si/c1-5-14(2,3)18-13(16)15(4)11-6-8-12(9-7-11)17-10-19/h6-9H,5,10H2,1-4H3
InChIKeyUYDJYRJXIIEEKK-UHFFFAOYSA-N
XLogP2.95
TPSA38.77 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.40
LogP ≤ 52.95
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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 CID 155769912?
The IUPAC name of CID 155769912 (CID 155769912) is not available.
What is the SMILES notation for CID 155769912?
The canonical SMILES for CID 155769912 is CCC(C)(C)OC(=O)N(C)c1ccc(OC[Si])cc1.
What is the InChIKey of CID 155769912?
The InChIKey is UYDJYRJXIIEEKK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20NO3Si/c1-5-14(2,3)18-13(16)15(4)11-6-8-12(9-7-11)17-10-19/h6-9H,5,10H2,1-4H3.
What are the key properties of CID 155769912?
CID 155769912 has a molecular weight of 278.40 g/mol, XLogP of 2.95, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for CID 155769912 is sourced from PubChem (CID 155769912), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).