dimethyl-[3-methyl-7-(4-propan-2-ylnaphthalen-2-yl)furo[2,3-c]pyridin-2-yl]-[4-(3,3,3-trifluoro-2,2-dimethylpropyl)phenyl]silane

C34H36F3NOSi — CID 170660375

About dimethyl-[3-methyl-7-(4-propan-2-ylnaphthalen-2-yl)furo[2,3-c]pyridin-2-yl]-[4-(3,3,3-trifluoro-2,2-dimethylpropyl)phenyl]silane

dimethyl-[3-methyl-7-(4-propan-2-ylnaphthalen-2-yl)furo[2,3-c]pyridin-2-yl]-[4-(3,3,3-trifluoro-2,2-dimethylpropyl)phenyl]silane (PubChem CID 170660375) has the molecular formula C34H36F3NOSi and a molecular weight of 559.75 g/mol. Its IUPAC name is dimethyl-[3-methyl-7-(4-propan-2-ylnaphthalen-2-yl)furo[2,3-c]pyridin-2-yl]-[4-(3,3,3-trifluoro-2,2-dimethylpropyl)phenyl]silane.

Molecular Properties

• Compound Name: dimethyl-[3-methyl-7-(4-propan-2-ylnaphthalen-2-yl)furo[2,3-c]pyridin-2-yl]-[4-(3,3,3-trifluoro-2,2-dimethylpropyl)phenyl]silane
• PubChem CID: 170660375
• Molecular Formula: C34H36F3NOSi
• Molecular Weight: 559.75 g/mol
• Exact Mass: 559.25
• IUPAC Name: dimethyl-[3-methyl-7-(4-propan-2-ylnaphthalen-2-yl)furo[2,3-c]pyridin-2-yl]-[4-(3,3,3-trifluoro-2,2-dimethylpropyl)phenyl]silane
• SMILES: Cc1c([Si](C)(C)c2ccc(CC(C)(C)C(F)(F)F)cc2)oc2c(-c3cc(C(C)C)c4ccccc4c3)nccc12
• InChI: InChI=1S/C34H36F3NOSi/c1-21(2)29-19-25(18-24-10-8-9-11-28(24)29)30-31-27(16-17-38-30)22(3)32(39-31)40(6,7)26-14-12-23(13-15-26)20-33(4,5)34(35,36)37/h8-19,21H,20H2,1-7H3
• InChIKey: ICFOOSHFNQFBTN-UHFFFAOYSA-N
• XLogP: 9.03
• TPSA: 26.03 Ų
• H-Bond Acceptors: 2
• Rotatable Bonds: 6
• Heavy Atoms: 40
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	559.75
LogP ≤ 5	9.03
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 dimethyl-[3-methyl-7-(4-propan-2-ylnaphthalen-2-yl)furo[2,3-c]pyridin-2-yl]-[4-(3,3,3-trifluoro-2,2-dimethylpropyl)phenyl]silane?

The IUPAC name of dimethyl-[3-methyl-7-(4-propan-2-ylnaphthalen-2-yl)furo[2,3-c]pyridin-2-yl]-[4-(3,3,3-trifluoro-2,2-dimethylpropyl)phenyl]silane (CID 170660375) is dimethyl-[3-methyl-7-(4-propan-2-ylnaphthalen-2-yl)furo[2,3-c]pyridin-2-yl]-[4-(3,3,3-trifluoro-2,2-dimethylpropyl)phenyl]silane.

What is the SMILES notation for dimethyl-[3-methyl-7-(4-propan-2-ylnaphthalen-2-yl)furo[2,3-c]pyridin-2-yl]-[4-(3,3,3-trifluoro-2,2-dimethylpropyl)phenyl]silane?

The canonical SMILES for dimethyl-[3-methyl-7-(4-propan-2-ylnaphthalen-2-yl)furo[2,3-c]pyridin-2-yl]-[4-(3,3,3-trifluoro-2,2-dimethylpropyl)phenyl]silane is Cc1c([Si](C)(C)c2ccc(CC(C)(C)C(F)(F)F)cc2)oc2c(-c3cc(C(C)C)c4ccccc4c3)nccc12.

What is the InChIKey of dimethyl-[3-methyl-7-(4-propan-2-ylnaphthalen-2-yl)furo[2,3-c]pyridin-2-yl]-[4-(3,3,3-trifluoro-2,2-dimethylpropyl)phenyl]silane?

The InChIKey is ICFOOSHFNQFBTN-UHFFFAOYSA-N. The full InChI is InChI=1S/C34H36F3NOSi/c1-21(2)29-19-25(18-24-10-8-9-11-28(24)29)30-31-27(16-17-38-30)22(3)32(39-31)40(6,7)26-14-12-23(13-15-26)20-33(4,5)34(35,36)37/h8-19,21H,20H2,1-7H3.

What are the key properties of dimethyl-[3-methyl-7-(4-propan-2-ylnaphthalen-2-yl)furo[2,3-c]pyridin-2-yl]-[4-(3,3,3-trifluoro-2,2-dimethylpropyl)phenyl]silane?

dimethyl-[3-methyl-7-(4-propan-2-ylnaphthalen-2-yl)furo[2,3-c]pyridin-2-yl]-[4-(3,3,3-trifluoro-2,2-dimethylpropyl)phenyl]silane has a molecular weight of 559.75 g/mol, XLogP of 9.03, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.

Where does this data come from?

All data for dimethyl-[3-methyl-7-(4-propan-2-ylnaphthalen-2-yl)furo[2,3-c]pyridin-2-yl]-[4-(3,3,3-trifluoro-2,2-dimethylpropyl)phenyl]silane is sourced from PubChem (CID 170660375), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).