CID 162380959

C10H16NO2Si — CID 162380959

IUPAC—
SMILESC=CC(=O)N1CC([Si]=C)C[C@@H]1COC
InChIInChI=1S/C10H16NO2Si/c1-4-10(12)11-6-9(14-3)5-8(11)7-13-2/h4,8-9H,1,3,5-7H2,2H3/t8-,9?/m1/s1
InChIKeyFGHQNFKLHWMYAZ-VEDVMXKPSA-N
MW210.33 g/mol
LogP0.34
Rot. Bonds4

About CID 162380959

CID 162380959 (PubChem CID 162380959) has the molecular formula C10H16NO2Si and a molecular weight of 210.33 g/mol.

Molecular Properties

Compound NameCID 162380959
PubChem CID162380959
Molecular FormulaC10H16NO2Si
Molecular Weight210.33 g/mol
Exact Mass210.10
IUPAC Name—
SMILESC=CC(=O)N1CC([Si]=C)C[C@@H]1COC
InChIInChI=1S/C10H16NO2Si/c1-4-10(12)11-6-9(14-3)5-8(11)7-13-2/h4,8-9H,1,3,5-7H2,2H3/t8-,9?/m1/s1
InChIKeyFGHQNFKLHWMYAZ-VEDVMXKPSA-N
XLogP0.34
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.33
LogP ≤ 50.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of CID 162380959?
The IUPAC name of CID 162380959 (CID 162380959) is not available.
What is the SMILES notation for CID 162380959?
The canonical SMILES for CID 162380959 is C=CC(=O)N1CC([Si]=C)C[C@@H]1COC.
What is the InChIKey of CID 162380959?
The InChIKey is FGHQNFKLHWMYAZ-VEDVMXKPSA-N. The full InChI is InChI=1S/C10H16NO2Si/c1-4-10(12)11-6-9(14-3)5-8(11)7-13-2/h4,8-9H,1,3,5-7H2,2H3/t8-,9?/m1/s1.
What are the key properties of CID 162380959?
CID 162380959 has a molecular weight of 210.33 g/mol, XLogP of 0.34, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for CID 162380959 is sourced from PubChem (CID 162380959), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).