About dimethyl-bis(5-methyl-2-methylidene-1H-cyclopenta[b]pyrrol-6-yl)silane
dimethyl-bis(5-methyl-2-methylidene-1H-cyclopenta[b]pyrrol-6-yl)silane (PubChem CID 91035897) has the molecular formula C20H22N2Si
and a molecular weight of 318.50 g/mol. Its IUPAC name is dimethyl-bis(5-methyl-2-methylidene-1H-cyclopenta[b]pyrrol-6-yl)silane.
Molecular Properties
| Compound Name | dimethyl-bis(5-methyl-2-methylidene-1H-cyclopenta[b]pyrrol-6-yl)silane |
| PubChem CID | 91035897 |
| Molecular Formula | C20H22N2Si |
| Molecular Weight | 318.50 g/mol |
| Exact Mass | 318.16 |
| IUPAC Name | dimethyl-bis(5-methyl-2-methylidene-1H-cyclopenta[b]pyrrol-6-yl)silane |
| SMILES | C=c1cc2c([nH]1)=C([Si](C)(C)C1=c3[nH]c(=C)cc3C=C1C)C(C)=C2 |
| InChI | InChI=1S/C20H22N2Si/c1-11-7-15-9-13(3)21-17(15)19(11)23(5,6)20-12(2)8-16-10-14(4)22-18(16)20/h7-10,21-22H,3-4H2,1-2,5-6H3 |
| InChIKey | VARCXCXNUANZTE-UHFFFAOYSA-N |
| XLogP | 1.79 |
| TPSA | 31.58 Ų |
| H-Bond Donors | 2 |
| H-Bond Acceptors | |
| Rotatable Bonds | 2 |
| Heavy Atoms | 23 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 318.50 |
| LogP ≤ 5 | 1.79 |
| H-Bond Donors ≤ 5 | 2 |
| H-Bond Acceptors ≤ 10 | 0 |
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 dimethyl-bis(5-methyl-2-methylidene-1H-cyclopenta[b]pyrrol-6-yl)silane?
The IUPAC name of dimethyl-bis(5-methyl-2-methylidene-1H-cyclopenta[b]pyrrol-6-yl)silane (CID 91035897) is dimethyl-bis(5-methyl-2-methylidene-1H-cyclopenta[b]pyrrol-6-yl)silane.
What is the SMILES notation for dimethyl-bis(5-methyl-2-methylidene-1H-cyclopenta[b]pyrrol-6-yl)silane?
The canonical SMILES for dimethyl-bis(5-methyl-2-methylidene-1H-cyclopenta[b]pyrrol-6-yl)silane is C=c1cc2c([nH]1)=C([Si](C)(C)C1=c3[nH]c(=C)cc3C=C1C)C(C)=C2.
What is the InChIKey of dimethyl-bis(5-methyl-2-methylidene-1H-cyclopenta[b]pyrrol-6-yl)silane?
The InChIKey is VARCXCXNUANZTE-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H22N2Si/c1-11-7-15-9-13(3)21-17(15)19(11)23(5,6)20-12(2)8-16-10-14(4)22-18(16)20/h7-10,21-22H,3-4H2,1-2,5-6H3.
What are the key properties of dimethyl-bis(5-methyl-2-methylidene-1H-cyclopenta[b]pyrrol-6-yl)silane?
dimethyl-bis(5-methyl-2-methylidene-1H-cyclopenta[b]pyrrol-6-yl)silane has a molecular weight of 318.50 g/mol, XLogP of 1.79, 2 rotatable bonds, 2 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for dimethyl-bis(5-methyl-2-methylidene-1H-cyclopenta[b]pyrrol-6-yl)silane is sourced from PubChem (CID 91035897), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).