(3-benzyltriazaphosphol-5-yl)-trimethylsilane

C11H16N3PSi — CID 13380284

IUPAC(3-benzyltriazaphosphol-5-yl)-trimethylsilane
SMILESC[Si](C)(C)c1nnn(Cc2ccccc2)p1
InChIInChI=1S/C11H16N3PSi/c1-16(2,3)11-12-13-14(15-11)9-10-7-5-4-6-8-10/h4-8H,9H2,1-3H3
InChIKeyKNMBUUNDQQHCLE-UHFFFAOYSA-N
MW249.33 g/mol
LogP2.45
Rot. Bonds3

About (3-benzyltriazaphosphol-5-yl)-trimethylsilane

(3-benzyltriazaphosphol-5-yl)-trimethylsilane (PubChem CID 13380284) has the molecular formula C11H16N3PSi and a molecular weight of 249.33 g/mol. Its IUPAC name is (3-benzyltriazaphosphol-5-yl)-trimethylsilane.

Molecular Properties

Compound Name(3-benzyltriazaphosphol-5-yl)-trimethylsilane
PubChem CID13380284
Molecular FormulaC11H16N3PSi
Molecular Weight249.33 g/mol
Exact Mass249.09
IUPAC Name(3-benzyltriazaphosphol-5-yl)-trimethylsilane
SMILESC[Si](C)(C)c1nnn(Cc2ccccc2)p1
InChIInChI=1S/C11H16N3PSi/c1-16(2,3)11-12-13-14(15-11)9-10-7-5-4-6-8-10/h4-8H,9H2,1-3H3
InChIKeyKNMBUUNDQQHCLE-UHFFFAOYSA-N
XLogP2.45
TPSA30.71 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.33
LogP ≤ 52.45
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

3-Methyl-5-phenyltriazaphosphole
CID 14000513
Magnesium benzyl-[benzyl-[methanidyl(dimethyl)silyl]amino]azanide
CID 11232045
3-Benzyl-5-tert-butyltriazaphosphole
CID 13360634

Frequently Asked Questions

What is the IUPAC name of (3-benzyltriazaphosphol-5-yl)-trimethylsilane?
The IUPAC name of (3-benzyltriazaphosphol-5-yl)-trimethylsilane (CID 13380284) is (3-benzyltriazaphosphol-5-yl)-trimethylsilane.
What is the SMILES notation for (3-benzyltriazaphosphol-5-yl)-trimethylsilane?
The canonical SMILES for (3-benzyltriazaphosphol-5-yl)-trimethylsilane is C[Si](C)(C)c1nnn(Cc2ccccc2)p1.
What is the InChIKey of (3-benzyltriazaphosphol-5-yl)-trimethylsilane?
The InChIKey is KNMBUUNDQQHCLE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N3PSi/c1-16(2,3)11-12-13-14(15-11)9-10-7-5-4-6-8-10/h4-8H,9H2,1-3H3.
What are the key properties of (3-benzyltriazaphosphol-5-yl)-trimethylsilane?
(3-benzyltriazaphosphol-5-yl)-trimethylsilane has a molecular weight of 249.33 g/mol, XLogP of 2.45, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3-benzyltriazaphosphol-5-yl)-trimethylsilane is sourced from PubChem (CID 13380284), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).