2-(2,2,5,5-tetramethyl-1,2,5-azadisilolidin-1-yl)acetonitrile

C8H18N2Si2 — CID 87071868

IUPAC2-(2,2,5,5-tetramethyl-1,2,5-azadisilolidin-1-yl)acetonitrile
SMILESC[Si]1(C)CC[Si](C)(C)N1CC#N
InChIInChI=1S/C8H18N2Si2/c1-11(2)7-8-12(3,4)10(11)6-5-9/h6-8H2,1-4H3
InChIKeyDVYKGHQNYIKLKC-UHFFFAOYSA-N
MW198.42 g/mol
LogP2.24
Rot. Bonds1

About 2-(2,2,5,5-tetramethyl-1,2,5-azadisilolidin-1-yl)acetonitrile

2-(2,2,5,5-tetramethyl-1,2,5-azadisilolidin-1-yl)acetonitrile (PubChem CID 87071868) has the molecular formula C8H18N2Si2 and a molecular weight of 198.42 g/mol. Its IUPAC name is 2-(2,2,5,5-tetramethyl-1,2,5-azadisilolidin-1-yl)acetonitrile.

Molecular Properties

Compound Name2-(2,2,5,5-tetramethyl-1,2,5-azadisilolidin-1-yl)acetonitrile
PubChem CID87071868
Molecular FormulaC8H18N2Si2
Molecular Weight198.42 g/mol
Exact Mass198.10
IUPAC Name2-(2,2,5,5-tetramethyl-1,2,5-azadisilolidin-1-yl)acetonitrile
SMILESC[Si]1(C)CC[Si](C)(C)N1CC#N
InChIInChI=1S/C8H18N2Si2/c1-11(2)7-8-12(3,4)10(11)6-5-9/h6-8H2,1-4H3
InChIKeyDVYKGHQNYIKLKC-UHFFFAOYSA-N
XLogP2.24
TPSA27.03 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.42
LogP ≤ 52.24
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze 2-(2,2,5,5-tetramethyl-1,2,5-azadisilolidin-1-yl)acetonitrile 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 2-(2,2,5,5-tetramethyl-1,2,5-azadisilolidin-1-yl)acetonitrile?
The IUPAC name of 2-(2,2,5,5-tetramethyl-1,2,5-azadisilolidin-1-yl)acetonitrile (CID 87071868) is 2-(2,2,5,5-tetramethyl-1,2,5-azadisilolidin-1-yl)acetonitrile.
What is the SMILES notation for 2-(2,2,5,5-tetramethyl-1,2,5-azadisilolidin-1-yl)acetonitrile?
The canonical SMILES for 2-(2,2,5,5-tetramethyl-1,2,5-azadisilolidin-1-yl)acetonitrile is C[Si]1(C)CC[Si](C)(C)N1CC#N.
What is the InChIKey of 2-(2,2,5,5-tetramethyl-1,2,5-azadisilolidin-1-yl)acetonitrile?
The InChIKey is DVYKGHQNYIKLKC-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H18N2Si2/c1-11(2)7-8-12(3,4)10(11)6-5-9/h6-8H2,1-4H3.
What are the key properties of 2-(2,2,5,5-tetramethyl-1,2,5-azadisilolidin-1-yl)acetonitrile?
2-(2,2,5,5-tetramethyl-1,2,5-azadisilolidin-1-yl)acetonitrile has a molecular weight of 198.42 g/mol, XLogP of 2.24, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,2,5,5-tetramethyl-1,2,5-azadisilolidin-1-yl)acetonitrile is sourced from PubChem (CID 87071868), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).