About 4-chloro-N-(2-methyltetrazol-5-yl)pyridin-2-amine
4-chloro-N-(2-methyltetrazol-5-yl)pyridin-2-amine (PubChem CID 170352602) has the molecular formula C7H7ClN6
and a molecular weight of 210.63 g/mol. Its IUPAC name is 4-chloro-N-(2-methyltetrazol-5-yl)pyridin-2-amine.
Molecular Properties
| Compound Name | 4-chloro-N-(2-methyltetrazol-5-yl)pyridin-2-amine |
| PubChem CID | 170352602 |
| Molecular Formula | C7H7ClN6 |
| Molecular Weight | 210.63 g/mol |
| Exact Mass | 210.04 |
| IUPAC Name | 4-chloro-N-(2-methyltetrazol-5-yl)pyridin-2-amine |
| SMILES | Cn1nnc(Nc2cc(Cl)ccn2)n1 |
| InChI | InChI=1S/C7H7ClN6/c1-14-12-7(11-13-14)10-6-4-5(8)2-3-9-6/h2-4H,1H3,(H,9,10,12) |
| InChIKey | JKZWVWDAIRUSTE-UHFFFAOYSA-N |
| XLogP | 1.00 |
| TPSA | 68.52 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Heavy Atoms | 14 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 210.63 |
| LogP ≤ 5 | 1.00 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 6 |
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Frequently Asked Questions
What is the IUPAC name of 4-chloro-N-(2-methyltetrazol-5-yl)pyridin-2-amine?
The IUPAC name of 4-chloro-N-(2-methyltetrazol-5-yl)pyridin-2-amine (CID 170352602) is 4-chloro-N-(2-methyltetrazol-5-yl)pyridin-2-amine.
What is the SMILES notation for 4-chloro-N-(2-methyltetrazol-5-yl)pyridin-2-amine?
The canonical SMILES for 4-chloro-N-(2-methyltetrazol-5-yl)pyridin-2-amine is Cn1nnc(Nc2cc(Cl)ccn2)n1.
What is the InChIKey of 4-chloro-N-(2-methyltetrazol-5-yl)pyridin-2-amine?
The InChIKey is JKZWVWDAIRUSTE-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H7ClN6/c1-14-12-7(11-13-14)10-6-4-5(8)2-3-9-6/h2-4H,1H3,(H,9,10,12).
What are the key properties of 4-chloro-N-(2-methyltetrazol-5-yl)pyridin-2-amine?
4-chloro-N-(2-methyltetrazol-5-yl)pyridin-2-amine has a molecular weight of 210.63 g/mol, XLogP of 1.00, 2 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-N-(2-methyltetrazol-5-yl)pyridin-2-amine is sourced from PubChem (CID 170352602), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).