CID 59983969

C14H27O2Si — CID 59983969

IUPAC—
SMILESCC[C@H]1CC(=O)C[C@H](O[Si](CC)C(C)(C)C)C1
InChIInChI=1S/C14H27O2Si/c1-6-11-8-12(15)10-13(9-11)16-17(7-2)14(3,4)5/h11,13H,6-10H2,1-5H3/t11-,13+/m0/s1
InChIKeyFAQSZAOWNPZXPT-WCQYABFASA-N
MW255.45 g/mol
LogP3.96
Rot. Bonds4

About CID 59983969

CID 59983969 (PubChem CID 59983969) has the molecular formula C14H27O2Si and a molecular weight of 255.45 g/mol.

Molecular Properties

Compound NameCID 59983969
PubChem CID59983969
Molecular FormulaC14H27O2Si
Molecular Weight255.45 g/mol
Exact Mass255.18
IUPAC Name—
SMILESCC[C@H]1CC(=O)C[C@H](O[Si](CC)C(C)(C)C)C1
InChIInChI=1S/C14H27O2Si/c1-6-11-8-12(15)10-13(9-11)16-17(7-2)14(3,4)5/h11,13H,6-10H2,1-5H3/t11-,13+/m0/s1
InChIKeyFAQSZAOWNPZXPT-WCQYABFASA-N
XLogP3.96
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.45
LogP ≤ 53.96
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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 59983969?
The IUPAC name of CID 59983969 (CID 59983969) is not available.
What is the SMILES notation for CID 59983969?
The canonical SMILES for CID 59983969 is CC[C@H]1CC(=O)C[C@H](O[Si](CC)C(C)(C)C)C1.
What is the InChIKey of CID 59983969?
The InChIKey is FAQSZAOWNPZXPT-WCQYABFASA-N. The full InChI is InChI=1S/C14H27O2Si/c1-6-11-8-12(15)10-13(9-11)16-17(7-2)14(3,4)5/h11,13H,6-10H2,1-5H3/t11-,13+/m0/s1.
What are the key properties of CID 59983969?
CID 59983969 has a molecular weight of 255.45 g/mol, XLogP of 3.96, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for CID 59983969 is sourced from PubChem (CID 59983969), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).