CID 20700384

C13H10NSi — CID 20700384

IUPAC
SMILES[Si]c1ccc(/C=C/c2ccccc2)cn1
InChIInChI=1S/C13H10NSi/c15-13-9-8-12(10-14-13)7-6-11-4-2-1-3-5-11/h1-10H/b7-6+
InChIKeyALFHIVOLKOAFCA-VOTSOKGWSA-N
MW208.32 g/mol
LogP2.05
Rot. Bonds2

About CID 20700384

CID 20700384 (PubChem CID 20700384) has the molecular formula C13H10NSi and a molecular weight of 208.32 g/mol.

Molecular Properties

Compound NameCID 20700384
PubChem CID20700384
Molecular FormulaC13H10NSi
Molecular Weight208.32 g/mol
Exact Mass208.06
IUPAC Name
SMILES[Si]c1ccc(/C=C/c2ccccc2)cn1
InChIInChI=1S/C13H10NSi/c15-13-9-8-12(10-14-13)7-6-11-4-2-1-3-5-11/h1-10H/b7-6+
InChIKeyALFHIVOLKOAFCA-VOTSOKGWSA-N
XLogP2.05
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.32
LogP ≤ 52.05
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 20700384?
The IUPAC name of CID 20700384 (CID 20700384) is not available.
What is the SMILES notation for CID 20700384?
The canonical SMILES for CID 20700384 is [Si]c1ccc(/C=C/c2ccccc2)cn1.
What is the InChIKey of CID 20700384?
The InChIKey is ALFHIVOLKOAFCA-VOTSOKGWSA-N. The full InChI is InChI=1S/C13H10NSi/c15-13-9-8-12(10-14-13)7-6-11-4-2-1-3-5-11/h1-10H/b7-6+.
What are the key properties of CID 20700384?
CID 20700384 has a molecular weight of 208.32 g/mol, XLogP of 2.05, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for CID 20700384 is sourced from PubChem (CID 20700384), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).