tert-butyl-[(6-cyclopropyl-[1,2,4]triazolo[4,3-a]pyridin-7-yl)methoxy]-dimethylsilane

C16H25N3OSi — CID 90456078

IUPACtert-butyl-[(6-cyclopropyl-[1,2,4]triazolo[4,3-a]pyridin-7-yl)methoxy]-dimethylsilane
SMILESCC(C)(C)[Si](C)(C)OCc1cc2nncn2cc1C1CC1
InChIInChI=1S/C16H25N3OSi/c1-16(2,3)21(4,5)20-10-13-8-15-18-17-11-19(15)9-14(13)12-6-7-12/h8-9,11-12H,6-7,10H2,1-5H3
InChIKeyWTLUKGKGINLUDV-UHFFFAOYSA-N
MW303.48 g/mol
LogP4.13
Rot. Bonds4

About tert-butyl-[(6-cyclopropyl-[1,2,4]triazolo[4,3-a]pyridin-7-yl)methoxy]-dimethylsilane

tert-butyl-[(6-cyclopropyl-[1,2,4]triazolo[4,3-a]pyridin-7-yl)methoxy]-dimethylsilane (PubChem CID 90456078) has the molecular formula C16H25N3OSi and a molecular weight of 303.48 g/mol. Its IUPAC name is tert-butyl-[(6-cyclopropyl-[1,2,4]triazolo[4,3-a]pyridin-7-yl)methoxy]-dimethylsilane.

Molecular Properties

Compound Nametert-butyl-[(6-cyclopropyl-[1,2,4]triazolo[4,3-a]pyridin-7-yl)methoxy]-dimethylsilane
PubChem CID90456078
Molecular FormulaC16H25N3OSi
Molecular Weight303.48 g/mol
Exact Mass303.18
IUPAC Nametert-butyl-[(6-cyclopropyl-[1,2,4]triazolo[4,3-a]pyridin-7-yl)methoxy]-dimethylsilane
SMILESCC(C)(C)[Si](C)(C)OCc1cc2nncn2cc1C1CC1
InChIInChI=1S/C16H25N3OSi/c1-16(2,3)21(4,5)20-10-13-8-15-18-17-11-19(15)9-14(13)12-6-7-12/h8-9,11-12H,6-7,10H2,1-5H3
InChIKeyWTLUKGKGINLUDV-UHFFFAOYSA-N
XLogP4.13
TPSA39.42 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.48
LogP ≤ 54.13
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze tert-butyl-[(6-cyclopropyl-[1,2,4]triazolo[4,3-a]pyridin-7-yl)methoxy]-dimethylsilane 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 tert-butyl-[(6-cyclopropyl-[1,2,4]triazolo[4,3-a]pyridin-7-yl)methoxy]-dimethylsilane?
The IUPAC name of tert-butyl-[(6-cyclopropyl-[1,2,4]triazolo[4,3-a]pyridin-7-yl)methoxy]-dimethylsilane (CID 90456078) is tert-butyl-[(6-cyclopropyl-[1,2,4]triazolo[4,3-a]pyridin-7-yl)methoxy]-dimethylsilane.
What is the SMILES notation for tert-butyl-[(6-cyclopropyl-[1,2,4]triazolo[4,3-a]pyridin-7-yl)methoxy]-dimethylsilane?
The canonical SMILES for tert-butyl-[(6-cyclopropyl-[1,2,4]triazolo[4,3-a]pyridin-7-yl)methoxy]-dimethylsilane is CC(C)(C)[Si](C)(C)OCc1cc2nncn2cc1C1CC1.
What is the InChIKey of tert-butyl-[(6-cyclopropyl-[1,2,4]triazolo[4,3-a]pyridin-7-yl)methoxy]-dimethylsilane?
The InChIKey is WTLUKGKGINLUDV-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25N3OSi/c1-16(2,3)21(4,5)20-10-13-8-15-18-17-11-19(15)9-14(13)12-6-7-12/h8-9,11-12H,6-7,10H2,1-5H3.
What are the key properties of tert-butyl-[(6-cyclopropyl-[1,2,4]triazolo[4,3-a]pyridin-7-yl)methoxy]-dimethylsilane?
tert-butyl-[(6-cyclopropyl-[1,2,4]triazolo[4,3-a]pyridin-7-yl)methoxy]-dimethylsilane has a molecular weight of 303.48 g/mol, XLogP of 4.13, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-[(6-cyclopropyl-[1,2,4]triazolo[4,3-a]pyridin-7-yl)methoxy]-dimethylsilane is sourced from PubChem (CID 90456078), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).