About 1-(1-methyltetrazol-5-yl)piperidin-4-amine;hydrochloride
1-(1-methyltetrazol-5-yl)piperidin-4-amine;hydrochloride (PubChem CID 50988505) has the molecular formula C7H15ClN6
and a molecular weight of 218.69 g/mol. Its IUPAC name is 1-(1-methyltetrazol-5-yl)piperidin-4-amine;hydrochloride.
Molecular Properties
| Compound Name | 1-(1-methyltetrazol-5-yl)piperidin-4-amine;hydrochloride |
| PubChem CID | 50988505 |
| Molecular Formula | C7H15ClN6 |
| Molecular Weight | 218.69 g/mol |
| Exact Mass | 218.10 |
| IUPAC Name | 1-(1-methyltetrazol-5-yl)piperidin-4-amine;hydrochloride |
| SMILES | Cl.Cn1nnnc1N1CCC(N)CC1 |
| InChI | InChI=1S/C7H14N6.ClH/c1-12-7(9-10-11-12)13-4-2-6(8)3-5-13;/h6H,2-5,8H2,1H3;1H |
| InChIKey | SWOLZFDRXDGBLI-UHFFFAOYSA-N |
| XLogP | -0.44 |
| TPSA | 72.86 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 6 |
| Rotatable Bonds | 1 |
| Heavy Atoms | 14 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 218.69 |
| LogP ≤ 5 | -0.44 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 6 |
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Frequently Asked Questions
What is the IUPAC name of 1-(1-methyltetrazol-5-yl)piperidin-4-amine;hydrochloride?
The IUPAC name of 1-(1-methyltetrazol-5-yl)piperidin-4-amine;hydrochloride (CID 50988505) is 1-(1-methyltetrazol-5-yl)piperidin-4-amine;hydrochloride.
What is the SMILES notation for 1-(1-methyltetrazol-5-yl)piperidin-4-amine;hydrochloride?
The canonical SMILES for 1-(1-methyltetrazol-5-yl)piperidin-4-amine;hydrochloride is Cl.Cn1nnnc1N1CCC(N)CC1.
What is the InChIKey of 1-(1-methyltetrazol-5-yl)piperidin-4-amine;hydrochloride?
The InChIKey is SWOLZFDRXDGBLI-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H14N6.ClH/c1-12-7(9-10-11-12)13-4-2-6(8)3-5-13;/h6H,2-5,8H2,1H3;1H.
What are the key properties of 1-(1-methyltetrazol-5-yl)piperidin-4-amine;hydrochloride?
1-(1-methyltetrazol-5-yl)piperidin-4-amine;hydrochloride has a molecular weight of 218.69 g/mol, XLogP of -0.44, 1 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-methyltetrazol-5-yl)piperidin-4-amine;hydrochloride is sourced from PubChem (CID 50988505), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).