About 2-methyl-N-[(2-methylcyclopentyl)methyl]cyclohexan-1-amine
2-methyl-N-[(2-methylcyclopentyl)methyl]cyclohexan-1-amine (PubChem CID 107417002) has the molecular formula C14H27N
and a molecular weight of 209.38 g/mol. Its IUPAC name is 2-methyl-N-[(2-methylcyclopentyl)methyl]cyclohexan-1-amine.
Molecular Properties
| Compound Name | 2-methyl-N-[(2-methylcyclopentyl)methyl]cyclohexan-1-amine |
| PubChem CID | 107417002 |
| Molecular Formula | C14H27N |
| Molecular Weight | 209.38 g/mol |
| Exact Mass | 209.21 |
| IUPAC Name | 2-methyl-N-[(2-methylcyclopentyl)methyl]cyclohexan-1-amine |
| SMILES | CC1CCCC1CNC1CCCCC1C |
| InChI | InChI=1S/C14H27N/c1-11-7-5-8-13(11)10-15-14-9-4-3-6-12(14)2/h11-15H,3-10H2,1-2H3 |
| InChIKey | HMLVAQRQWUNPAF-UHFFFAOYSA-N |
| XLogP | 3.59 |
| TPSA | 12.03 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Heavy Atoms | 15 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 209.38 |
| LogP ≤ 5 | 3.59 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 1 |
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Frequently Asked Questions
What is the IUPAC name of 2-methyl-N-[(2-methylcyclopentyl)methyl]cyclohexan-1-amine?
The IUPAC name of 2-methyl-N-[(2-methylcyclopentyl)methyl]cyclohexan-1-amine (CID 107417002) is 2-methyl-N-[(2-methylcyclopentyl)methyl]cyclohexan-1-amine.
What is the SMILES notation for 2-methyl-N-[(2-methylcyclopentyl)methyl]cyclohexan-1-amine?
The canonical SMILES for 2-methyl-N-[(2-methylcyclopentyl)methyl]cyclohexan-1-amine is CC1CCCC1CNC1CCCCC1C.
What is the InChIKey of 2-methyl-N-[(2-methylcyclopentyl)methyl]cyclohexan-1-amine?
The InChIKey is HMLVAQRQWUNPAF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H27N/c1-11-7-5-8-13(11)10-15-14-9-4-3-6-12(14)2/h11-15H,3-10H2,1-2H3.
What are the key properties of 2-methyl-N-[(2-methylcyclopentyl)methyl]cyclohexan-1-amine?
2-methyl-N-[(2-methylcyclopentyl)methyl]cyclohexan-1-amine has a molecular weight of 209.38 g/mol, XLogP of 3.59, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-[(2-methylcyclopentyl)methyl]cyclohexan-1-amine is sourced from PubChem (CID 107417002), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).