About 3-ethenyl-6-prop-1-enyl-1H-inden-1-amine
3-ethenyl-6-prop-1-enyl-1H-inden-1-amine (PubChem CID 162275013) has the molecular formula C14H15N
and a molecular weight of 197.28 g/mol. Its IUPAC name is 3-ethenyl-6-prop-1-enyl-1H-inden-1-amine.
Molecular Properties
| Compound Name | 3-ethenyl-6-prop-1-enyl-1H-inden-1-amine |
| PubChem CID | 162275013 |
| Molecular Formula | C14H15N |
| Molecular Weight | 197.28 g/mol |
| Exact Mass | 197.12 |
| IUPAC Name | 3-ethenyl-6-prop-1-enyl-1H-inden-1-amine |
| SMILES | C=CC1=CC(N)c2cc(C=CC)ccc21 |
| InChI | InChI=1S/C14H15N/c1-3-5-10-6-7-12-11(4-2)9-14(15)13(12)8-10/h3-9,14H,2,15H2,1H3 |
| InChIKey | PWAFVWGZZZIXAF-UHFFFAOYSA-N |
| XLogP | 3.30 |
| TPSA | 26.02 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Heavy Atoms | 15 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 197.28 |
| LogP ≤ 5 | 3.30 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 1 |
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Frequently Asked Questions
What is the IUPAC name of 3-ethenyl-6-prop-1-enyl-1H-inden-1-amine?
The IUPAC name of 3-ethenyl-6-prop-1-enyl-1H-inden-1-amine (CID 162275013) is 3-ethenyl-6-prop-1-enyl-1H-inden-1-amine.
What is the SMILES notation for 3-ethenyl-6-prop-1-enyl-1H-inden-1-amine?
The canonical SMILES for 3-ethenyl-6-prop-1-enyl-1H-inden-1-amine is C=CC1=CC(N)c2cc(C=CC)ccc21.
What is the InChIKey of 3-ethenyl-6-prop-1-enyl-1H-inden-1-amine?
The InChIKey is PWAFVWGZZZIXAF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15N/c1-3-5-10-6-7-12-11(4-2)9-14(15)13(12)8-10/h3-9,14H,2,15H2,1H3.
What are the key properties of 3-ethenyl-6-prop-1-enyl-1H-inden-1-amine?
3-ethenyl-6-prop-1-enyl-1H-inden-1-amine has a molecular weight of 197.28 g/mol, XLogP of 3.30, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethenyl-6-prop-1-enyl-1H-inden-1-amine is sourced from PubChem (CID 162275013), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).