About cyclopropane;N-[2-(5-fluoro-2-methoxy-3-pyridinyl)-1-methylpyrrolo[2,3-c]pyridin-5-yl]-N-methylhydroxylamine;uranium
cyclopropane;N-[2-(5-fluoro-2-methoxy-3-pyridinyl)-1-methylpyrrolo[2,3-c]pyridin-5-yl]-N-methylhydroxylamine;uranium (PubChem CID 163252319) has the molecular formula C18H21FN4O2U
and a molecular weight of 582.42 g/mol. Its IUPAC name is cyclopropane;N-[2-(5-fluoro-2-methoxy-3-pyridinyl)-1-methylpyrrolo[2,3-c]pyridin-5-yl]-N-methylhydroxylamine;uranium.
Molecular Properties
| Compound Name | cyclopropane;N-[2-(5-fluoro-2-methoxy-3-pyridinyl)-1-methylpyrrolo[2,3-c]pyridin-5-yl]-N-methylhydroxylamine;uranium |
| PubChem CID | 163252319 |
| Molecular Formula | C18H21FN4O2U |
| Molecular Weight | 582.42 g/mol |
| Exact Mass | 582.22 |
| IUPAC Name | cyclopropane;N-[2-(5-fluoro-2-methoxy-3-pyridinyl)-1-methylpyrrolo[2,3-c]pyridin-5-yl]-N-methylhydroxylamine;uranium |
| SMILES | C1CC1.COc1ncc(F)cc1-c1cc2cc(N(C)O)ncc2n1C.[U] |
| InChI | InChI=1S/C15H15FN4O2.C3H6.U/c1-19-12(11-6-10(16)7-18-15(11)22-3)4-9-5-14(20(2)21)17-8-13(9)19;1-2-3-1;/h4-8,21H,1-3H3;1-3H2; |
| InChIKey | KWZBQWDGEIBDTB-UHFFFAOYSA-N |
| XLogP | 3.78 |
| TPSA | 63.41 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Heavy Atoms | 26 |
| Complexity | — |
Lipinski Rule of Five
1 violation
| Rule | Value |
| MW ≤ 500 | 582.42 |
| LogP ≤ 5 | 3.78 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 6 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'} |
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Frequently Asked Questions
What is the IUPAC name of cyclopropane;N-[2-(5-fluoro-2-methoxy-3-pyridinyl)-1-methylpyrrolo[2,3-c]pyridin-5-yl]-N-methylhydroxylamine;uranium?
The IUPAC name of cyclopropane;N-[2-(5-fluoro-2-methoxy-3-pyridinyl)-1-methylpyrrolo[2,3-c]pyridin-5-yl]-N-methylhydroxylamine;uranium (CID 163252319) is cyclopropane;N-[2-(5-fluoro-2-methoxy-3-pyridinyl)-1-methylpyrrolo[2,3-c]pyridin-5-yl]-N-methylhydroxylamine;uranium.
What is the SMILES notation for cyclopropane;N-[2-(5-fluoro-2-methoxy-3-pyridinyl)-1-methylpyrrolo[2,3-c]pyridin-5-yl]-N-methylhydroxylamine;uranium?
The canonical SMILES for cyclopropane;N-[2-(5-fluoro-2-methoxy-3-pyridinyl)-1-methylpyrrolo[2,3-c]pyridin-5-yl]-N-methylhydroxylamine;uranium is C1CC1.COc1ncc(F)cc1-c1cc2cc(N(C)O)ncc2n1C.[U].
What is the InChIKey of cyclopropane;N-[2-(5-fluoro-2-methoxy-3-pyridinyl)-1-methylpyrrolo[2,3-c]pyridin-5-yl]-N-methylhydroxylamine;uranium?
The InChIKey is KWZBQWDGEIBDTB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15FN4O2.C3H6.U/c1-19-12(11-6-10(16)7-18-15(11)22-3)4-9-5-14(20(2)21)17-8-13(9)19;1-2-3-1;/h4-8,21H,1-3H3;1-3H2;.
What are the key properties of cyclopropane;N-[2-(5-fluoro-2-methoxy-3-pyridinyl)-1-methylpyrrolo[2,3-c]pyridin-5-yl]-N-methylhydroxylamine;uranium?
cyclopropane;N-[2-(5-fluoro-2-methoxy-3-pyridinyl)-1-methylpyrrolo[2,3-c]pyridin-5-yl]-N-methylhydroxylamine;uranium has a molecular weight of 582.42 g/mol, XLogP of 3.78, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for cyclopropane;N-[2-(5-fluoro-2-methoxy-3-pyridinyl)-1-methylpyrrolo[2,3-c]pyridin-5-yl]-N-methylhydroxylamine;uranium is sourced from PubChem (CID 163252319), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).