trimethyl-(1-propan-2-yltriazol-4-yl)silane

C8H17N3Si — CID 140904244

IUPACtrimethyl-(1-propan-2-yltriazol-4-yl)silane
SMILESCC(C)n1cc([Si](C)(C)C)nn1
InChIInChI=1S/C8H17N3Si/c1-7(2)11-6-8(9-10-11)12(3,4)5/h6-7H,1-5H3
InChIKeyKRAJGTRKPFUXRK-UHFFFAOYSA-N
MW183.33 g/mol
LogP1.40
Rot. Bonds2

About trimethyl-(1-propan-2-yltriazol-4-yl)silane

trimethyl-(1-propan-2-yltriazol-4-yl)silane (PubChem CID 140904244) has the molecular formula C8H17N3Si and a molecular weight of 183.33 g/mol. Its IUPAC name is trimethyl-(1-propan-2-yltriazol-4-yl)silane.

Molecular Properties

Compound Nametrimethyl-(1-propan-2-yltriazol-4-yl)silane
PubChem CID140904244
Molecular FormulaC8H17N3Si
Molecular Weight183.33 g/mol
Exact Mass183.12
IUPAC Nametrimethyl-(1-propan-2-yltriazol-4-yl)silane
SMILESCC(C)n1cc([Si](C)(C)C)nn1
InChIInChI=1S/C8H17N3Si/c1-7(2)11-6-8(9-10-11)12(3,4)5/h6-7H,1-5H3
InChIKeyKRAJGTRKPFUXRK-UHFFFAOYSA-N
XLogP1.40
TPSA30.71 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.33
LogP ≤ 51.40
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of trimethyl-(1-propan-2-yltriazol-4-yl)silane?
The IUPAC name of trimethyl-(1-propan-2-yltriazol-4-yl)silane (CID 140904244) is trimethyl-(1-propan-2-yltriazol-4-yl)silane.
What is the SMILES notation for trimethyl-(1-propan-2-yltriazol-4-yl)silane?
The canonical SMILES for trimethyl-(1-propan-2-yltriazol-4-yl)silane is CC(C)n1cc([Si](C)(C)C)nn1.
What is the InChIKey of trimethyl-(1-propan-2-yltriazol-4-yl)silane?
The InChIKey is KRAJGTRKPFUXRK-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H17N3Si/c1-7(2)11-6-8(9-10-11)12(3,4)5/h6-7H,1-5H3.
What are the key properties of trimethyl-(1-propan-2-yltriazol-4-yl)silane?
trimethyl-(1-propan-2-yltriazol-4-yl)silane has a molecular weight of 183.33 g/mol, XLogP of 1.40, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for trimethyl-(1-propan-2-yltriazol-4-yl)silane is sourced from PubChem (CID 140904244), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).