CID 136719157

C17H31O2Si — CID 136719157

IUPAC—
SMILESCC(/C=C/[Si](C(C)C)C(C)C)=C\COC1CCCCO1
InChIInChI=1S/C17H31O2Si/c1-14(2)20(15(3)4)13-10-16(5)9-12-19-17-8-6-7-11-18-17/h9-10,13-15,17H,6-8,11-12H2,1-5H3/b13-10+,16-9+
InChIKeyUDOPJTMNDZUVNI-HHRAEFMESA-N
MW295.52 g/mol
LogP4.89
Rot. Bonds7

About CID 136719157

CID 136719157 (PubChem CID 136719157) has the molecular formula C17H31O2Si and a molecular weight of 295.52 g/mol.

Molecular Properties

Compound NameCID 136719157
PubChem CID136719157
Molecular FormulaC17H31O2Si
Molecular Weight295.52 g/mol
Exact Mass295.21
IUPAC Name—
SMILESCC(/C=C/[Si](C(C)C)C(C)C)=C\COC1CCCCO1
InChIInChI=1S/C17H31O2Si/c1-14(2)20(15(3)4)13-10-16(5)9-12-19-17-8-6-7-11-18-17/h9-10,13-15,17H,6-8,11-12H2,1-5H3/b13-10+,16-9+
InChIKeyUDOPJTMNDZUVNI-HHRAEFMESA-N
XLogP4.89
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.52
LogP ≤ 54.89
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze CID 136719157 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 CID 136719157?
The IUPAC name of CID 136719157 (CID 136719157) is not available.
What is the SMILES notation for CID 136719157?
The canonical SMILES for CID 136719157 is CC(/C=C/[Si](C(C)C)C(C)C)=C\COC1CCCCO1.
What is the InChIKey of CID 136719157?
The InChIKey is UDOPJTMNDZUVNI-HHRAEFMESA-N. The full InChI is InChI=1S/C17H31O2Si/c1-14(2)20(15(3)4)13-10-16(5)9-12-19-17-8-6-7-11-18-17/h9-10,13-15,17H,6-8,11-12H2,1-5H3/b13-10+,16-9+.
What are the key properties of CID 136719157?
CID 136719157 has a molecular weight of 295.52 g/mol, XLogP of 4.89, 7 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for CID 136719157 is sourced from PubChem (CID 136719157), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).