1,4-ditert-butyl-2-phenyl-2,3-dihydro-1,4,2-diazasiline

C17H28N2Si — CID 135000129

IUPAC1,4-ditert-butyl-2-phenyl-2,3-dihydro-1,4,2-diazasiline
SMILESCC(C)(C)N1C=CN(C(C)(C)C)[SiH](c2ccccc2)C1
InChIInChI=1S/C17H28N2Si/c1-16(2,3)18-12-13-19(17(4,5)6)20(14-18)15-10-8-7-9-11-15/h7-13,20H,14H2,1-6H3
InChIKeyLOJZPGCQRLDWRH-UHFFFAOYSA-N
MW288.51 g/mol
LogP2.84
Rot. Bonds1

About 1,4-ditert-butyl-2-phenyl-2,3-dihydro-1,4,2-diazasiline

1,4-ditert-butyl-2-phenyl-2,3-dihydro-1,4,2-diazasiline (PubChem CID 135000129) has the molecular formula C17H28N2Si and a molecular weight of 288.51 g/mol. Its IUPAC name is 1,4-ditert-butyl-2-phenyl-2,3-dihydro-1,4,2-diazasiline.

Molecular Properties

Compound Name1,4-ditert-butyl-2-phenyl-2,3-dihydro-1,4,2-diazasiline
PubChem CID135000129
Molecular FormulaC17H28N2Si
Molecular Weight288.51 g/mol
Exact Mass288.20
IUPAC Name1,4-ditert-butyl-2-phenyl-2,3-dihydro-1,4,2-diazasiline
SMILESCC(C)(C)N1C=CN(C(C)(C)C)[SiH](c2ccccc2)C1
InChIInChI=1S/C17H28N2Si/c1-16(2,3)18-12-13-19(17(4,5)6)20(14-18)15-10-8-7-9-11-15/h7-13,20H,14H2,1-6H3
InChIKeyLOJZPGCQRLDWRH-UHFFFAOYSA-N
XLogP2.84
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.51
LogP ≤ 52.84
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze 1,4-ditert-butyl-2-phenyl-2,3-dihydro-1,4,2-diazasiline 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

2,2-diphenyl-1,4-di(propan-2-yl)-3H-1,4,2-diazasiline
CID 102306353
2-Phenyl-1,4-dipropyl-2,3-dihydro-1,4,2-diazasiline
CID 134999741
Tert-butyl-dimethyl-(2-phenylazaborinin-1-yl)silane
CID 69919534
dimethyl-[(3-methyl-2H-imidazol-1-yl)methyl]-phenylsilane
CID 91552113
2-Bromo-1,3-ditert-butyl-2-phenyl-1,3,2-diazasilole
CID 101177867
1,3-Ditert-butyl-2-iodo-2-phenyl-1,3,2-diazasilole
CID 101467931
dimethyl-phenyl-(4H-pyridin-1-yl)silane
CID 101537399
2-Phenyl-1,4-di(propan-2-yl)-2,3-dihydro-1,4,2-diazasiline
CID 102306352
Dimethyldivinyldiphenyldisilazane
CID 129807010
CID 134901664
CID 134901664
CID 136805967
CID 136805967
CID 139244833
CID 139244833

Frequently Asked Questions

What is the IUPAC name of 1,4-ditert-butyl-2-phenyl-2,3-dihydro-1,4,2-diazasiline?
The IUPAC name of 1,4-ditert-butyl-2-phenyl-2,3-dihydro-1,4,2-diazasiline (CID 135000129) is 1,4-ditert-butyl-2-phenyl-2,3-dihydro-1,4,2-diazasiline.
What is the SMILES notation for 1,4-ditert-butyl-2-phenyl-2,3-dihydro-1,4,2-diazasiline?
The canonical SMILES for 1,4-ditert-butyl-2-phenyl-2,3-dihydro-1,4,2-diazasiline is CC(C)(C)N1C=CN(C(C)(C)C)[SiH](c2ccccc2)C1.
What is the InChIKey of 1,4-ditert-butyl-2-phenyl-2,3-dihydro-1,4,2-diazasiline?
The InChIKey is LOJZPGCQRLDWRH-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H28N2Si/c1-16(2,3)18-12-13-19(17(4,5)6)20(14-18)15-10-8-7-9-11-15/h7-13,20H,14H2,1-6H3.
What are the key properties of 1,4-ditert-butyl-2-phenyl-2,3-dihydro-1,4,2-diazasiline?
1,4-ditert-butyl-2-phenyl-2,3-dihydro-1,4,2-diazasiline has a molecular weight of 288.51 g/mol, XLogP of 2.84, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1,4-ditert-butyl-2-phenyl-2,3-dihydro-1,4,2-diazasiline is sourced from PubChem (CID 135000129), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).