About 2-cyclopropyl-7-methylnaphthalene
2-cyclopropyl-7-methylnaphthalene (PubChem CID 176713070) has the molecular formula C14H14
and a molecular weight of 182.27 g/mol. Its IUPAC name is 2-cyclopropyl-7-methylnaphthalene.
Molecular Properties
| Compound Name | 2-cyclopropyl-7-methylnaphthalene |
| PubChem CID | 176713070 |
| Molecular Formula | C14H14 |
| Molecular Weight | 182.27 g/mol |
| Exact Mass | 182.11 |
| IUPAC Name | 2-cyclopropyl-7-methylnaphthalene |
| SMILES | Cc1ccc2ccc(C3CC3)cc2c1 |
| InChI | InChI=1S/C14H14/c1-10-2-3-12-6-7-13(11-4-5-11)9-14(12)8-10/h2-3,6-9,11H,4-5H2,1H3 |
| InChIKey | DMOBIXBUNBURBB-UHFFFAOYSA-N |
| XLogP | 4.03 |
| TPSA | 0.00 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | |
| Rotatable Bonds | 1 |
| Heavy Atoms | 14 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 182.27 |
| LogP ≤ 5 | 4.03 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 0 |
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Frequently Asked Questions
What is the IUPAC name of 2-cyclopropyl-7-methylnaphthalene?
The IUPAC name of 2-cyclopropyl-7-methylnaphthalene (CID 176713070) is 2-cyclopropyl-7-methylnaphthalene.
What is the SMILES notation for 2-cyclopropyl-7-methylnaphthalene?
The canonical SMILES for 2-cyclopropyl-7-methylnaphthalene is Cc1ccc2ccc(C3CC3)cc2c1.
What is the InChIKey of 2-cyclopropyl-7-methylnaphthalene?
The InChIKey is DMOBIXBUNBURBB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14/c1-10-2-3-12-6-7-13(11-4-5-11)9-14(12)8-10/h2-3,6-9,11H,4-5H2,1H3.
What are the key properties of 2-cyclopropyl-7-methylnaphthalene?
2-cyclopropyl-7-methylnaphthalene has a molecular weight of 182.27 g/mol, XLogP of 4.03, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-7-methylnaphthalene is sourced from PubChem (CID 176713070), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).