About [1-(dimethylamino)cyclopentyl]-(3-methylcyclohexyl)methanol
[1-(dimethylamino)cyclopentyl]-(3-methylcyclohexyl)methanol (PubChem CID 79067467) has the molecular formula C15H29NO
and a molecular weight of 239.40 g/mol. Its IUPAC name is [1-(dimethylamino)cyclopentyl]-(3-methylcyclohexyl)methanol.
Molecular Properties
| Compound Name | [1-(dimethylamino)cyclopentyl]-(3-methylcyclohexyl)methanol |
| PubChem CID | 79067467 |
| Molecular Formula | C15H29NO |
| Molecular Weight | 239.40 g/mol |
| Exact Mass | 239.22 |
| IUPAC Name | [1-(dimethylamino)cyclopentyl]-(3-methylcyclohexyl)methanol |
| SMILES | CC1CCCC(C(O)C2(N(C)C)CCCC2)C1 |
| InChI | InChI=1S/C15H29NO/c1-12-7-6-8-13(11-12)14(17)15(16(2)3)9-4-5-10-15/h12-14,17H,4-11H2,1-3H3 |
| InChIKey | UBJLCPNNIQRYRN-UHFFFAOYSA-N |
| XLogP | 3.05 |
| TPSA | 23.47 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Heavy Atoms | 17 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 239.40 |
| LogP ≤ 5 | 3.05 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 2 |
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Frequently Asked Questions
What is the IUPAC name of [1-(dimethylamino)cyclopentyl]-(3-methylcyclohexyl)methanol?
The IUPAC name of [1-(dimethylamino)cyclopentyl]-(3-methylcyclohexyl)methanol (CID 79067467) is [1-(dimethylamino)cyclopentyl]-(3-methylcyclohexyl)methanol.
What is the SMILES notation for [1-(dimethylamino)cyclopentyl]-(3-methylcyclohexyl)methanol?
The canonical SMILES for [1-(dimethylamino)cyclopentyl]-(3-methylcyclohexyl)methanol is CC1CCCC(C(O)C2(N(C)C)CCCC2)C1.
What is the InChIKey of [1-(dimethylamino)cyclopentyl]-(3-methylcyclohexyl)methanol?
The InChIKey is UBJLCPNNIQRYRN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H29NO/c1-12-7-6-8-13(11-12)14(17)15(16(2)3)9-4-5-10-15/h12-14,17H,4-11H2,1-3H3.
What are the key properties of [1-(dimethylamino)cyclopentyl]-(3-methylcyclohexyl)methanol?
[1-(dimethylamino)cyclopentyl]-(3-methylcyclohexyl)methanol has a molecular weight of 239.40 g/mol, XLogP of 3.05, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(dimethylamino)cyclopentyl]-(3-methylcyclohexyl)methanol is sourced from PubChem (CID 79067467), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).