(4-methoxyphenyl)-di(propan-2-yl)-pyridin-2-ylsilane

C₁₈H₂₅NOSi — CID 135076413

About (4-methoxyphenyl)-di(propan-2-yl)-pyridin-2-ylsilane

(4-methoxyphenyl)-di(propan-2-yl)-pyridin-2-ylsilane (PubChem CID 135076413) has the molecular formula C₁₈H₂₅NOSi and a molecular weight of 299.49 g/mol. Its IUPAC name is (4-methoxyphenyl)-di(propan-2-yl)-pyridin-2-ylsilane.

Molecular Properties

• Compound Name: (4-methoxyphenyl)-di(propan-2-yl)-pyridin-2-ylsilane
• PubChem CID: 135076413
• Molecular Formula: C₁₈H₂₅NOSi
• Molecular Weight: 299.49 g/mol
• Exact Mass: 299.17
• IUPAC Name: (4-methoxyphenyl)-di(propan-2-yl)-pyridin-2-ylsilane
• SMILES: COc1ccc([Si](c2ccccn2)(C(C)C)C(C)C)cc1
• InChI: InChI=1S/C18H25NOSi/c1-14(2)21(15(3)4,18-8-6-7-13-19-18)17-11-9-16(20-5)10-12-17/h6-15H,1-5H3
• InChIKey: RYNVJVBSSPAPRK-UHFFFAOYSA-N
• XLogP: 3.47
• TPSA: 22.12 Ų
• H-Bond Acceptors: 2
• Rotatable Bonds: 5
• Heavy Atoms: 21
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	299.49
LogP ≤ 5	3.47
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	2

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of (4-methoxyphenyl)-di(propan-2-yl)-pyridin-2-ylsilane?

The IUPAC name of (4-methoxyphenyl)-di(propan-2-yl)-pyridin-2-ylsilane (CID 135076413) is (4-methoxyphenyl)-di(propan-2-yl)-pyridin-2-ylsilane.

What is the SMILES notation for (4-methoxyphenyl)-di(propan-2-yl)-pyridin-2-ylsilane?

The canonical SMILES for (4-methoxyphenyl)-di(propan-2-yl)-pyridin-2-ylsilane is COc1ccc([Si](c2ccccn2)(C(C)C)C(C)C)cc1.

What is the InChIKey of (4-methoxyphenyl)-di(propan-2-yl)-pyridin-2-ylsilane?

The InChIKey is RYNVJVBSSPAPRK-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H25NOSi/c1-14(2)21(15(3)4,18-8-6-7-13-19-18)17-11-9-16(20-5)10-12-17/h6-15H,1-5H3.

What are the key properties of (4-methoxyphenyl)-di(propan-2-yl)-pyridin-2-ylsilane?

(4-methoxyphenyl)-di(propan-2-yl)-pyridin-2-ylsilane has a molecular weight of 299.49 g/mol, XLogP of 3.47, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.

Where does this data come from?

All data for (4-methoxyphenyl)-di(propan-2-yl)-pyridin-2-ylsilane is sourced from PubChem (CID 135076413), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).

Sources

• PubChem CID 135076413 — identifiers, structure, computed properties (public domain)

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