CID 155673242

C16H27OSi — CID 155673242

IUPAC—
SMILESC[Si](C)OC(C#CC1CC1)C1CCC1C(C)(C)C
InChIInChI=1S/C16H27OSi/c1-16(2,3)14-10-9-13(14)15(17-18(4)5)11-8-12-6-7-12/h12-15H,6-7,9-10H2,1-5H3
InChIKeyHGXHDAOOJTXXCY-UHFFFAOYSA-N
MW263.48 g/mol
LogP4.11
Rot. Bonds3

About CID 155673242

CID 155673242 (PubChem CID 155673242) has the molecular formula C16H27OSi and a molecular weight of 263.48 g/mol.

Molecular Properties

Compound NameCID 155673242
PubChem CID155673242
Molecular FormulaC16H27OSi
Molecular Weight263.48 g/mol
Exact Mass263.18
IUPAC Name—
SMILESC[Si](C)OC(C#CC1CC1)C1CCC1C(C)(C)C
InChIInChI=1S/C16H27OSi/c1-16(2,3)14-10-9-13(14)15(17-18(4)5)11-8-12-6-7-12/h12-15H,6-7,9-10H2,1-5H3
InChIKeyHGXHDAOOJTXXCY-UHFFFAOYSA-N
XLogP4.11
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.48
LogP ≤ 54.11
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of CID 155673242?
The IUPAC name of CID 155673242 (CID 155673242) is not available.
What is the SMILES notation for CID 155673242?
The canonical SMILES for CID 155673242 is C[Si](C)OC(C#CC1CC1)C1CCC1C(C)(C)C.
What is the InChIKey of CID 155673242?
The InChIKey is HGXHDAOOJTXXCY-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H27OSi/c1-16(2,3)14-10-9-13(14)15(17-18(4)5)11-8-12-6-7-12/h12-15H,6-7,9-10H2,1-5H3.
What are the key properties of CID 155673242?
CID 155673242 has a molecular weight of 263.48 g/mol, XLogP of 4.11, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for CID 155673242 is sourced from PubChem (CID 155673242), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).