CID 119079833

C12H13NSi — CID 119079833

IUPAC—
SMILESCN(C)[Si]c1cccc2ccccc12
InChIInChI=1S/C12H13NSi/c1-13(2)14-12-9-5-7-10-6-3-4-8-11(10)12/h3-9H,1-2H3
InChIKeyJSRHIYWSBZDSQP-UHFFFAOYSA-N
MW199.33 g/mol
LogP1.65
Rot. Bonds2

About CID 119079833

CID 119079833 (PubChem CID 119079833) has the molecular formula C12H13NSi and a molecular weight of 199.33 g/mol.

Molecular Properties

Compound NameCID 119079833
PubChem CID119079833
Molecular FormulaC12H13NSi
Molecular Weight199.33 g/mol
Exact Mass199.08
IUPAC Name—
SMILESCN(C)[Si]c1cccc2ccccc12
InChIInChI=1S/C12H13NSi/c1-13(2)14-12-9-5-7-10-6-3-4-8-11(10)12/h3-9H,1-2H3
InChIKeyJSRHIYWSBZDSQP-UHFFFAOYSA-N
XLogP1.65
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.33
LogP ≤ 51.65
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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 119079833?
The IUPAC name of CID 119079833 (CID 119079833) is not available.
What is the SMILES notation for CID 119079833?
The canonical SMILES for CID 119079833 is CN(C)[Si]c1cccc2ccccc12.
What is the InChIKey of CID 119079833?
The InChIKey is JSRHIYWSBZDSQP-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H13NSi/c1-13(2)14-12-9-5-7-10-6-3-4-8-11(10)12/h3-9H,1-2H3.
What are the key properties of CID 119079833?
CID 119079833 has a molecular weight of 199.33 g/mol, XLogP of 1.65, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for CID 119079833 is sourced from PubChem (CID 119079833), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).