1-(7-fluoro-2-oxo-1H-quinoline-3-carbonyl)-N-(5-methyl-1,2-oxazol-3-yl)pyrrolidine-2-carboxamide

C19H17FN4O4 — CID 110624659

About 1-(7-fluoro-2-oxo-1H-quinoline-3-carbonyl)-N-(5-methyl-1,2-oxazol-3-yl)pyrrolidine-2-carboxamide

1-(7-fluoro-2-oxo-1H-quinoline-3-carbonyl)-N-(5-methyl-1,2-oxazol-3-yl)pyrrolidine-2-carboxamide (PubChem CID 110624659) has the molecular formula C19H17FN4O4 and a molecular weight of 384.37 g/mol. Its IUPAC name is 1-(7-fluoro-2-oxo-1H-quinoline-3-carbonyl)-N-(5-methyl-1,2-oxazol-3-yl)pyrrolidine-2-carboxamide.

Molecular Properties

• Compound Name: 1-(7-fluoro-2-oxo-1H-quinoline-3-carbonyl)-N-(5-methyl-1,2-oxazol-3-yl)pyrrolidine-2-carboxamide
• PubChem CID: 110624659
• Molecular Formula: C19H17FN4O4
• Molecular Weight: 384.37 g/mol
• Exact Mass: 384.12
• IUPAC Name: 1-(7-fluoro-2-oxo-1H-quinoline-3-carbonyl)-N-(5-methyl-1,2-oxazol-3-yl)pyrrolidine-2-carboxamide
• SMILES: Cc1cc(NC(=O)C2CCCN2C(=O)c2cc3ccc(F)cc3[nH]c2=O)no1
• InChI: InChI=1S/C19H17FN4O4/c1-10-7-16(23-28-10)22-18(26)15-3-2-6-24(15)19(27)13-8-11-4-5-12(20)9-14(11)21-17(13)25/h4-5,7-9,15H,2-3,6H2,1H3,(H,21,25)(H,22,23,26)
• InChIKey: XNPUTPKJQYOILZ-UHFFFAOYSA-N
• XLogP: 2.21
• TPSA: 108.30 Ų
• H-Bond Donors: 2
• H-Bond Acceptors: 5
• Rotatable Bonds: 3
• Heavy Atoms: 28
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	384.37
LogP ≤ 5	2.21
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	5

Frequently Asked Questions

What is the IUPAC name of 1-(7-fluoro-2-oxo-1H-quinoline-3-carbonyl)-N-(5-methyl-1,2-oxazol-3-yl)pyrrolidine-2-carboxamide?

The IUPAC name of 1-(7-fluoro-2-oxo-1H-quinoline-3-carbonyl)-N-(5-methyl-1,2-oxazol-3-yl)pyrrolidine-2-carboxamide (CID 110624659) is 1-(7-fluoro-2-oxo-1H-quinoline-3-carbonyl)-N-(5-methyl-1,2-oxazol-3-yl)pyrrolidine-2-carboxamide.

What is the SMILES notation for 1-(7-fluoro-2-oxo-1H-quinoline-3-carbonyl)-N-(5-methyl-1,2-oxazol-3-yl)pyrrolidine-2-carboxamide?

The canonical SMILES for 1-(7-fluoro-2-oxo-1H-quinoline-3-carbonyl)-N-(5-methyl-1,2-oxazol-3-yl)pyrrolidine-2-carboxamide is Cc1cc(NC(=O)C2CCCN2C(=O)c2cc3ccc(F)cc3[nH]c2=O)no1.

What is the InChIKey of 1-(7-fluoro-2-oxo-1H-quinoline-3-carbonyl)-N-(5-methyl-1,2-oxazol-3-yl)pyrrolidine-2-carboxamide?

The InChIKey is XNPUTPKJQYOILZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17FN4O4/c1-10-7-16(23-28-10)22-18(26)15-3-2-6-24(15)19(27)13-8-11-4-5-12(20)9-14(11)21-17(13)25/h4-5,7-9,15H,2-3,6H2,1H3,(H,21,25)(H,22,23,26).

What are the key properties of 1-(7-fluoro-2-oxo-1H-quinoline-3-carbonyl)-N-(5-methyl-1,2-oxazol-3-yl)pyrrolidine-2-carboxamide?

1-(7-fluoro-2-oxo-1H-quinoline-3-carbonyl)-N-(5-methyl-1,2-oxazol-3-yl)pyrrolidine-2-carboxamide has a molecular weight of 384.37 g/mol, XLogP of 2.21, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.

Where does this data come from?

All data for 1-(7-fluoro-2-oxo-1H-quinoline-3-carbonyl)-N-(5-methyl-1,2-oxazol-3-yl)pyrrolidine-2-carboxamide is sourced from PubChem (CID 110624659), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).