About [2-[(4-chlorophenyl)methoxy]-6-methyl-3-pyridinyl]methanamine
[2-[(4-chlorophenyl)methoxy]-6-methyl-3-pyridinyl]methanamine (PubChem CID 65126764) has the molecular formula C14H15ClN2O
and a molecular weight of 262.74 g/mol. Its IUPAC name is [2-[(4-chlorophenyl)methoxy]-6-methyl-3-pyridinyl]methanamine.
Molecular Properties
| Compound Name | [2-[(4-chlorophenyl)methoxy]-6-methyl-3-pyridinyl]methanamine |
| PubChem CID | 65126764 |
| Molecular Formula | C14H15ClN2O |
| Molecular Weight | 262.74 g/mol |
| Exact Mass | 262.09 |
| IUPAC Name | [2-[(4-chlorophenyl)methoxy]-6-methyl-3-pyridinyl]methanamine |
| SMILES | Cc1ccc(CN)c(OCc2ccc(Cl)cc2)n1 |
| InChI | InChI=1S/C14H15ClN2O/c1-10-2-5-12(8-16)14(17-10)18-9-11-3-6-13(15)7-4-11/h2-7H,8-9,16H2,1H3 |
| InChIKey | PQHFWGBYLWZTJO-UHFFFAOYSA-N |
| XLogP | 3.08 |
| TPSA | 48.14 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Heavy Atoms | 18 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 262.74 |
| LogP ≤ 5 | 3.08 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 3 |
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Frequently Asked Questions
What is the IUPAC name of [2-[(4-chlorophenyl)methoxy]-6-methyl-3-pyridinyl]methanamine?
The IUPAC name of [2-[(4-chlorophenyl)methoxy]-6-methyl-3-pyridinyl]methanamine (CID 65126764) is [2-[(4-chlorophenyl)methoxy]-6-methyl-3-pyridinyl]methanamine.
What is the SMILES notation for [2-[(4-chlorophenyl)methoxy]-6-methyl-3-pyridinyl]methanamine?
The canonical SMILES for [2-[(4-chlorophenyl)methoxy]-6-methyl-3-pyridinyl]methanamine is Cc1ccc(CN)c(OCc2ccc(Cl)cc2)n1.
What is the InChIKey of [2-[(4-chlorophenyl)methoxy]-6-methyl-3-pyridinyl]methanamine?
The InChIKey is PQHFWGBYLWZTJO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15ClN2O/c1-10-2-5-12(8-16)14(17-10)18-9-11-3-6-13(15)7-4-11/h2-7H,8-9,16H2,1H3.
What are the key properties of [2-[(4-chlorophenyl)methoxy]-6-methyl-3-pyridinyl]methanamine?
[2-[(4-chlorophenyl)methoxy]-6-methyl-3-pyridinyl]methanamine has a molecular weight of 262.74 g/mol, XLogP of 3.08, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [2-[(4-chlorophenyl)methoxy]-6-methyl-3-pyridinyl]methanamine is sourced from PubChem (CID 65126764), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).