CID 134901664

C12H16NSi — CID 134901664

IUPAC—
SMILESC[Si](c1ccccc1)N1C=CCCC1
InChIInChI=1S/C12H16NSi/c1-14(12-8-4-2-5-9-12)13-10-6-3-7-11-13/h2,4-6,8-10H,3,7,11H2,1H3
InChIKeyJIZBNYUCTQQLEW-UHFFFAOYSA-N
MW202.35 g/mol
LogP2.12
Rot. Bonds2

About CID 134901664

CID 134901664 (PubChem CID 134901664) has the molecular formula C12H16NSi and a molecular weight of 202.35 g/mol.

Molecular Properties

Compound NameCID 134901664
PubChem CID134901664
Molecular FormulaC12H16NSi
Molecular Weight202.35 g/mol
Exact Mass202.11
IUPAC Name—
SMILESC[Si](c1ccccc1)N1C=CCCC1
InChIInChI=1S/C12H16NSi/c1-14(12-8-4-2-5-9-12)13-10-6-3-7-11-13/h2,4-6,8-10H,3,7,11H2,1H3
InChIKeyJIZBNYUCTQQLEW-UHFFFAOYSA-N
XLogP2.12
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.35
LogP ≤ 52.12
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}

Analyze CID 134901664 with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of CID 134901664?
The IUPAC name of CID 134901664 (CID 134901664) is not available.
What is the SMILES notation for CID 134901664?
The canonical SMILES for CID 134901664 is C[Si](c1ccccc1)N1C=CCCC1.
What is the InChIKey of CID 134901664?
The InChIKey is JIZBNYUCTQQLEW-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16NSi/c1-14(12-8-4-2-5-9-12)13-10-6-3-7-11-13/h2,4-6,8-10H,3,7,11H2,1H3.
What are the key properties of CID 134901664?
CID 134901664 has a molecular weight of 202.35 g/mol, XLogP of 2.12, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for CID 134901664 is sourced from PubChem (CID 134901664), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).