CID 100979280

C8H12NSi — CID 100979280

IUPAC
SMILES[CH2][Si](C)(C)c1ccccn1
InChIInChI=1S/C8H12NSi/c1-10(2,3)8-6-4-5-7-9-8/h4-7H,1H2,2-3H3
InChIKeyVOQQQZWXVFBCHX-UHFFFAOYSA-N
MW150.28 g/mol
LogP1.37
Rot. Bonds1

About CID 100979280

CID 100979280 (PubChem CID 100979280) has the molecular formula C8H12NSi and a molecular weight of 150.28 g/mol.

Molecular Properties

Compound NameCID 100979280
PubChem CID100979280
Molecular FormulaC8H12NSi
Molecular Weight150.28 g/mol
Exact Mass150.07
IUPAC Name
SMILES[CH2][Si](C)(C)c1ccccn1
InChIInChI=1S/C8H12NSi/c1-10(2,3)8-6-4-5-7-9-8/h4-7H,1H2,2-3H3
InChIKeyVOQQQZWXVFBCHX-UHFFFAOYSA-N
XLogP1.37
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms10
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500150.28
LogP ≤ 51.37
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 100979280?
The IUPAC name of CID 100979280 (CID 100979280) is not available.
What is the SMILES notation for CID 100979280?
The canonical SMILES for CID 100979280 is [CH2][Si](C)(C)c1ccccn1.
What is the InChIKey of CID 100979280?
The InChIKey is VOQQQZWXVFBCHX-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H12NSi/c1-10(2,3)8-6-4-5-7-9-8/h4-7H,1H2,2-3H3.
What are the key properties of CID 100979280?
CID 100979280 has a molecular weight of 150.28 g/mol, XLogP of 1.37, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for CID 100979280 is sourced from PubChem (CID 100979280), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).