cyclopropane;N-[2-(5-fluoro-2-methoxy-3-pyridinyl)-1-methylpyrrolo[2,3-c]pyridin-5-yl]-N-methylhydroxylamine;uranium

C18H21FN4O2U — CID 163252319

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'}

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).