CID 156635115

C12H12N2Si — CID 156635115

IUPAC—
SMILESCC(C)(C)[Si]c1cccc(C#N)c1C#N
InChIInChI=1S/C12H12N2Si/c1-12(2,3)15-11-6-4-5-9(7-13)10(11)8-14/h4-6H,1-3H3
InChIKeyOTGDGPBCEJMXJG-UHFFFAOYSA-N
MW212.33 g/mol
LogP1.98
Rot. Bonds1

About CID 156635115

CID 156635115 (PubChem CID 156635115) has the molecular formula C12H12N2Si and a molecular weight of 212.33 g/mol.

Molecular Properties

Compound NameCID 156635115
PubChem CID156635115
Molecular FormulaC12H12N2Si
Molecular Weight212.33 g/mol
Exact Mass212.08
IUPAC Name—
SMILESCC(C)(C)[Si]c1cccc(C#N)c1C#N
InChIInChI=1S/C12H12N2Si/c1-12(2,3)15-11-6-4-5-9(7-13)10(11)8-14/h4-6H,1-3H3
InChIKeyOTGDGPBCEJMXJG-UHFFFAOYSA-N
XLogP1.98
TPSA47.58 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.33
LogP ≤ 51.98
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze CID 156635115 with MolForge

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

Launch Full Analysis

Related Compounds

3-[2-(2,3-dicyanophenyl)ethynyl]benzene-1,2-dicarbonitrile
CID 176917652
2-(tert-butylamino)pyridine-3,4-dicarbonitrile
CID 10442777
2-ethynyl-3-methylbenzonitrile
CID 173092424
3-tert-butyl-2-methoxybenzonitrile
CID 10397629
naphthalene-1,2,8-tricarbonitrile
CID 54287628
3-[2-(2,3-dicyanophenoxy)phenoxy]benzene-1,2-dicarbonitrile
CID 19922197
3-chloro-2-methoxybenzonitrile
CID 82652815
3-(2,4-ditert-butylphenoxy)benzene-1,2-dicarbonitrile
CID 57005555
3-methylbenzene-1,2,4-tricarbonitrile
CID 54234334
3-(furan-3-yl)benzene-1,2-dicarbonitrile
CID 76539722
azane;benzene-1,2-dicarbonitrile
CID 141338892
benzene-1,2-dicarbonitrile;tetrahydrofluoride
CID 174356358

Frequently Asked Questions

What is the IUPAC name of CID 156635115?
The IUPAC name of CID 156635115 (CID 156635115) is not available.
What is the SMILES notation for CID 156635115?
The canonical SMILES for CID 156635115 is CC(C)(C)[Si]c1cccc(C#N)c1C#N.
What is the InChIKey of CID 156635115?
The InChIKey is OTGDGPBCEJMXJG-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H12N2Si/c1-12(2,3)15-11-6-4-5-9(7-13)10(11)8-14/h4-6H,1-3H3.
What are the key properties of CID 156635115?
CID 156635115 has a molecular weight of 212.33 g/mol, XLogP of 1.98, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for CID 156635115 is sourced from PubChem (CID 156635115), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).