About N-butyl-N-(2-methoxyethyl)piperidine-2-carboxamide;hydrochloride
N-butyl-N-(2-methoxyethyl)piperidine-2-carboxamide;hydrochloride (PubChem CID 119322175) has the molecular formula C13H27ClN2O2
and a molecular weight of 278.82 g/mol. Its IUPAC name is N-butyl-N-(2-methoxyethyl)piperidine-2-carboxamide;hydrochloride.
Molecular Properties
| Compound Name | N-butyl-N-(2-methoxyethyl)piperidine-2-carboxamide;hydrochloride |
| PubChem CID | 119322175 |
| Molecular Formula | C13H27ClN2O2 |
| Molecular Weight | 278.82 g/mol |
| Exact Mass | 278.18 |
| IUPAC Name | N-butyl-N-(2-methoxyethyl)piperidine-2-carboxamide;hydrochloride |
| SMILES | CCCCN(CCOC)C(=O)C1CCCCN1.Cl |
| InChI | InChI=1S/C13H26N2O2.ClH/c1-3-4-9-15(10-11-17-2)13(16)12-7-5-6-8-14-12;/h12,14H,3-11H2,1-2H3;1H |
| InChIKey | MCOAZLNEJONGMJ-UHFFFAOYSA-N |
| XLogP | 1.83 |
| TPSA | 41.57 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 7 |
| Heavy Atoms | 18 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 278.82 |
| LogP ≤ 5 | 1.83 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 3 |
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Frequently Asked Questions
What is the IUPAC name of N-butyl-N-(2-methoxyethyl)piperidine-2-carboxamide;hydrochloride?
The IUPAC name of N-butyl-N-(2-methoxyethyl)piperidine-2-carboxamide;hydrochloride (CID 119322175) is N-butyl-N-(2-methoxyethyl)piperidine-2-carboxamide;hydrochloride.
What is the SMILES notation for N-butyl-N-(2-methoxyethyl)piperidine-2-carboxamide;hydrochloride?
The canonical SMILES for N-butyl-N-(2-methoxyethyl)piperidine-2-carboxamide;hydrochloride is CCCCN(CCOC)C(=O)C1CCCCN1.Cl.
What is the InChIKey of N-butyl-N-(2-methoxyethyl)piperidine-2-carboxamide;hydrochloride?
The InChIKey is MCOAZLNEJONGMJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N2O2.ClH/c1-3-4-9-15(10-11-17-2)13(16)12-7-5-6-8-14-12;/h12,14H,3-11H2,1-2H3;1H.
What are the key properties of N-butyl-N-(2-methoxyethyl)piperidine-2-carboxamide;hydrochloride?
N-butyl-N-(2-methoxyethyl)piperidine-2-carboxamide;hydrochloride has a molecular weight of 278.82 g/mol, XLogP of 1.83, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-butyl-N-(2-methoxyethyl)piperidine-2-carboxamide;hydrochloride is sourced from PubChem (CID 119322175), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).