6-diphenylsilylidenecyclohexa-2,4-dien-1-amine

C18H17NSi — CID 161182347

IUPAC6-diphenylsilylidenecyclohexa-2,4-dien-1-amine
SMILESNC1C=CC=CC1=[Si](c1ccccc1)c1ccccc1
InChIInChI=1S/C18H17NSi/c19-17-13-7-8-14-18(17)20(15-9-3-1-4-10-15)16-11-5-2-6-12-16/h1-14,17H,19H2
InChIKeyRXQJAPRHAJFOQK-UHFFFAOYSA-N
MW275.43 g/mol
LogP1.50
Rot. Bonds2

About 6-diphenylsilylidenecyclohexa-2,4-dien-1-amine

6-diphenylsilylidenecyclohexa-2,4-dien-1-amine (PubChem CID 161182347) has the molecular formula C18H17NSi and a molecular weight of 275.43 g/mol. Its IUPAC name is 6-diphenylsilylidenecyclohexa-2,4-dien-1-amine.

Molecular Properties

Compound Name6-diphenylsilylidenecyclohexa-2,4-dien-1-amine
PubChem CID161182347
Molecular FormulaC18H17NSi
Molecular Weight275.43 g/mol
Exact Mass275.11
IUPAC Name6-diphenylsilylidenecyclohexa-2,4-dien-1-amine
SMILESNC1C=CC=CC1=[Si](c1ccccc1)c1ccccc1
InChIInChI=1S/C18H17NSi/c19-17-13-7-8-14-18(17)20(15-9-3-1-4-10-15)16-11-5-2-6-12-16/h1-14,17H,19H2
InChIKeyRXQJAPRHAJFOQK-UHFFFAOYSA-N
XLogP1.50
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.43
LogP ≤ 51.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze 6-diphenylsilylidenecyclohexa-2,4-dien-1-amine 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 6-diphenylsilylidenecyclohexa-2,4-dien-1-amine?
The IUPAC name of 6-diphenylsilylidenecyclohexa-2,4-dien-1-amine (CID 161182347) is 6-diphenylsilylidenecyclohexa-2,4-dien-1-amine.
What is the SMILES notation for 6-diphenylsilylidenecyclohexa-2,4-dien-1-amine?
The canonical SMILES for 6-diphenylsilylidenecyclohexa-2,4-dien-1-amine is NC1C=CC=CC1=[Si](c1ccccc1)c1ccccc1.
What is the InChIKey of 6-diphenylsilylidenecyclohexa-2,4-dien-1-amine?
The InChIKey is RXQJAPRHAJFOQK-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H17NSi/c19-17-13-7-8-14-18(17)20(15-9-3-1-4-10-15)16-11-5-2-6-12-16/h1-14,17H,19H2.
What are the key properties of 6-diphenylsilylidenecyclohexa-2,4-dien-1-amine?
6-diphenylsilylidenecyclohexa-2,4-dien-1-amine has a molecular weight of 275.43 g/mol, XLogP of 1.50, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 6-diphenylsilylidenecyclohexa-2,4-dien-1-amine is sourced from PubChem (CID 161182347), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).