CID 68623736

C12H20N2OSi — CID 68623736

IUPAC—
SMILESCC(C)(C)[Si]OC(C)(C)c1ccc(N)cn1
InChIInChI=1S/C12H20N2OSi/c1-11(2,3)16-15-12(4,5)10-7-6-9(13)8-14-10/h6-8H,13H2,1-5H3
InChIKeyRUQRAZMKKWMHHC-UHFFFAOYSA-N
MW236.39 g/mol
LogP2.75
Rot. Bonds3

About CID 68623736

CID 68623736 (PubChem CID 68623736) has the molecular formula C12H20N2OSi and a molecular weight of 236.39 g/mol.

Molecular Properties

Compound NameCID 68623736
PubChem CID68623736
Molecular FormulaC12H20N2OSi
Molecular Weight236.39 g/mol
Exact Mass236.13
IUPAC Name—
SMILESCC(C)(C)[Si]OC(C)(C)c1ccc(N)cn1
InChIInChI=1S/C12H20N2OSi/c1-11(2,3)16-15-12(4,5)10-7-6-9(13)8-14-10/h6-8H,13H2,1-5H3
InChIKeyRUQRAZMKKWMHHC-UHFFFAOYSA-N
XLogP2.75
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.39
LogP ≤ 52.75
H-Bond Donors ≤ 51
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 68623736?
The IUPAC name of CID 68623736 (CID 68623736) is not available.
What is the SMILES notation for CID 68623736?
The canonical SMILES for CID 68623736 is CC(C)(C)[Si]OC(C)(C)c1ccc(N)cn1.
What is the InChIKey of CID 68623736?
The InChIKey is RUQRAZMKKWMHHC-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N2OSi/c1-11(2,3)16-15-12(4,5)10-7-6-9(13)8-14-10/h6-8H,13H2,1-5H3.
What are the key properties of CID 68623736?
CID 68623736 has a molecular weight of 236.39 g/mol, XLogP of 2.75, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for CID 68623736 is sourced from PubChem (CID 68623736), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).