CID 119078098

C19H16NSi — CID 119078098

IUPAC—
SMILESCN1c2ccccc2[Si](c2ccccc2)c2ccccc21
InChIInChI=1S/C19H16NSi/c1-20-16-11-5-7-13-18(16)21(15-9-3-2-4-10-15)19-14-8-6-12-17(19)20/h2-14H,1H3
InChIKeyQYKJAHNXJSSDHB-UHFFFAOYSA-N
MW286.43 g/mol
LogP2.28
Rot. Bonds1

About CID 119078098

CID 119078098 (PubChem CID 119078098) has the molecular formula C19H16NSi and a molecular weight of 286.43 g/mol.

Molecular Properties

Compound NameCID 119078098
PubChem CID119078098
Molecular FormulaC19H16NSi
Molecular Weight286.43 g/mol
Exact Mass286.11
IUPAC Name—
SMILESCN1c2ccccc2[Si](c2ccccc2)c2ccccc21
InChIInChI=1S/C19H16NSi/c1-20-16-11-5-7-13-18(16)21(15-9-3-2-4-10-15)19-14-8-6-12-17(19)20/h2-14H,1H3
InChIKeyQYKJAHNXJSSDHB-UHFFFAOYSA-N
XLogP2.28
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.43
LogP ≤ 52.28
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 119078098?
The IUPAC name of CID 119078098 (CID 119078098) is not available.
What is the SMILES notation for CID 119078098?
The canonical SMILES for CID 119078098 is CN1c2ccccc2[Si](c2ccccc2)c2ccccc21.
What is the InChIKey of CID 119078098?
The InChIKey is QYKJAHNXJSSDHB-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H16NSi/c1-20-16-11-5-7-13-18(16)21(15-9-3-2-4-10-15)19-14-8-6-12-17(19)20/h2-14H,1H3.
What are the key properties of CID 119078098?
CID 119078098 has a molecular weight of 286.43 g/mol, XLogP of 2.28, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for CID 119078098 is sourced from PubChem (CID 119078098), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).