1-[(2-fluorophenyl)methyl]-N-(5-methyl-1,3,4-thiadiazol-2-yl)-2-oxo-1,8-naphthyridine-3-carboxamide

C19H14FN5O2S — CID 7621080

About 1-[(2-fluorophenyl)methyl]-N-(5-methyl-1,3,4-thiadiazol-2-yl)-2-oxo-1,8-naphthyridine-3-carboxamide

1-[(2-fluorophenyl)methyl]-N-(5-methyl-1,3,4-thiadiazol-2-yl)-2-oxo-1,8-naphthyridine-3-carboxamide (PubChem CID 7621080) has the molecular formula C19H14FN5O2S and a molecular weight of 395.42 g/mol. Its IUPAC name is 1-[(2-fluorophenyl)methyl]-N-(5-methyl-1,3,4-thiadiazol-2-yl)-2-oxo-1,8-naphthyridine-3-carboxamide.

Molecular Properties

• Compound Name: 1-[(2-fluorophenyl)methyl]-N-(5-methyl-1,3,4-thiadiazol-2-yl)-2-oxo-1,8-naphthyridine-3-carboxamide
• PubChem CID: 7621080
• Molecular Formula: C19H14FN5O2S
• Molecular Weight: 395.42 g/mol
• Exact Mass: 395.09
• IUPAC Name: 1-[(2-fluorophenyl)methyl]-N-(5-methyl-1,3,4-thiadiazol-2-yl)-2-oxo-1,8-naphthyridine-3-carboxamide
• SMILES: Cc1nnc(NC(=O)c2cc3cccnc3n(Cc3ccccc3F)c2=O)s1
• InChI: InChI=1S/C19H14FN5O2S/c1-11-23-24-19(28-11)22-17(26)14-9-12-6-4-8-21-16(12)25(18(14)27)10-13-5-2-3-7-15(13)20/h2-9H,10H2,1H3,(H,22,24,26)
• InChIKey: NAGZWXGTJDYCET-UHFFFAOYSA-N
• XLogP: 3.00
• TPSA: 89.77 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 7
• Rotatable Bonds: 4
• Heavy Atoms: 28
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	395.42
LogP ≤ 5	3.00
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	7

Frequently Asked Questions

What is the IUPAC name of 1-[(2-fluorophenyl)methyl]-N-(5-methyl-1,3,4-thiadiazol-2-yl)-2-oxo-1,8-naphthyridine-3-carboxamide?

The IUPAC name of 1-[(2-fluorophenyl)methyl]-N-(5-methyl-1,3,4-thiadiazol-2-yl)-2-oxo-1,8-naphthyridine-3-carboxamide (CID 7621080) is 1-[(2-fluorophenyl)methyl]-N-(5-methyl-1,3,4-thiadiazol-2-yl)-2-oxo-1,8-naphthyridine-3-carboxamide.

What is the SMILES notation for 1-[(2-fluorophenyl)methyl]-N-(5-methyl-1,3,4-thiadiazol-2-yl)-2-oxo-1,8-naphthyridine-3-carboxamide?

The canonical SMILES for 1-[(2-fluorophenyl)methyl]-N-(5-methyl-1,3,4-thiadiazol-2-yl)-2-oxo-1,8-naphthyridine-3-carboxamide is Cc1nnc(NC(=O)c2cc3cccnc3n(Cc3ccccc3F)c2=O)s1.

What is the InChIKey of 1-[(2-fluorophenyl)methyl]-N-(5-methyl-1,3,4-thiadiazol-2-yl)-2-oxo-1,8-naphthyridine-3-carboxamide?

The InChIKey is NAGZWXGTJDYCET-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H14FN5O2S/c1-11-23-24-19(28-11)22-17(26)14-9-12-6-4-8-21-16(12)25(18(14)27)10-13-5-2-3-7-15(13)20/h2-9H,10H2,1H3,(H,22,24,26).

What are the key properties of 1-[(2-fluorophenyl)methyl]-N-(5-methyl-1,3,4-thiadiazol-2-yl)-2-oxo-1,8-naphthyridine-3-carboxamide?

1-[(2-fluorophenyl)methyl]-N-(5-methyl-1,3,4-thiadiazol-2-yl)-2-oxo-1,8-naphthyridine-3-carboxamide has a molecular weight of 395.42 g/mol, XLogP of 3.00, 4 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.

Where does this data come from?

All data for 1-[(2-fluorophenyl)methyl]-N-(5-methyl-1,3,4-thiadiazol-2-yl)-2-oxo-1,8-naphthyridine-3-carboxamide is sourced from PubChem (CID 7621080), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).