6-[(4-chlorophenyl)methyl]-N-[(5-fluoro-2-pyridinyl)methyl]-2-methyl-5-oxo-1,6-naphthyridine-3-carboxamide

C23H18ClFN4O2 — CID 169248867

About 6-[(4-chlorophenyl)methyl]-N-[(5-fluoro-2-pyridinyl)methyl]-2-methyl-5-oxo-1,6-naphthyridine-3-carboxamide

6-[(4-chlorophenyl)methyl]-N-[(5-fluoro-2-pyridinyl)methyl]-2-methyl-5-oxo-1,6-naphthyridine-3-carboxamide (PubChem CID 169248867) has the molecular formula C23H18ClFN4O2 and a molecular weight of 436.87 g/mol. Its IUPAC name is 6-[(4-chlorophenyl)methyl]-N-[(5-fluoro-2-pyridinyl)methyl]-2-methyl-5-oxo-1,6-naphthyridine-3-carboxamide.

Molecular Properties

• Compound Name: 6-[(4-chlorophenyl)methyl]-N-[(5-fluoro-2-pyridinyl)methyl]-2-methyl-5-oxo-1,6-naphthyridine-3-carboxamide
• PubChem CID: 169248867
• Molecular Formula: C23H18ClFN4O2
• Molecular Weight: 436.87 g/mol
• Exact Mass: 436.11
• IUPAC Name: 6-[(4-chlorophenyl)methyl]-N-[(5-fluoro-2-pyridinyl)methyl]-2-methyl-5-oxo-1,6-naphthyridine-3-carboxamide
• SMILES: Cc1nc2ccn(Cc3ccc(Cl)cc3)c(=O)c2cc1C(=O)NCc1ccc(F)cn1
• InChI: InChI=1S/C23H18ClFN4O2/c1-14-19(22(30)27-12-18-7-6-17(25)11-26-18)10-20-21(28-14)8-9-29(23(20)31)13-15-2-4-16(24)5-3-15/h2-11H,12-13H2,1H3,(H,27,30)
• InChIKey: AMZLGLHBXDPNNL-UHFFFAOYSA-N
• XLogP: 3.87
• TPSA: 76.88 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 5
• Rotatable Bonds: 5
• Heavy Atoms: 31
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	436.87
LogP ≤ 5	3.87
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	5

Frequently Asked Questions

What is the IUPAC name of 6-[(4-chlorophenyl)methyl]-N-[(5-fluoro-2-pyridinyl)methyl]-2-methyl-5-oxo-1,6-naphthyridine-3-carboxamide?

The IUPAC name of 6-[(4-chlorophenyl)methyl]-N-[(5-fluoro-2-pyridinyl)methyl]-2-methyl-5-oxo-1,6-naphthyridine-3-carboxamide (CID 169248867) is 6-[(4-chlorophenyl)methyl]-N-[(5-fluoro-2-pyridinyl)methyl]-2-methyl-5-oxo-1,6-naphthyridine-3-carboxamide.

What is the SMILES notation for 6-[(4-chlorophenyl)methyl]-N-[(5-fluoro-2-pyridinyl)methyl]-2-methyl-5-oxo-1,6-naphthyridine-3-carboxamide?

The canonical SMILES for 6-[(4-chlorophenyl)methyl]-N-[(5-fluoro-2-pyridinyl)methyl]-2-methyl-5-oxo-1,6-naphthyridine-3-carboxamide is Cc1nc2ccn(Cc3ccc(Cl)cc3)c(=O)c2cc1C(=O)NCc1ccc(F)cn1.

What is the InChIKey of 6-[(4-chlorophenyl)methyl]-N-[(5-fluoro-2-pyridinyl)methyl]-2-methyl-5-oxo-1,6-naphthyridine-3-carboxamide?

The InChIKey is AMZLGLHBXDPNNL-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H18ClFN4O2/c1-14-19(22(30)27-12-18-7-6-17(25)11-26-18)10-20-21(28-14)8-9-29(23(20)31)13-15-2-4-16(24)5-3-15/h2-11H,12-13H2,1H3,(H,27,30).

What are the key properties of 6-[(4-chlorophenyl)methyl]-N-[(5-fluoro-2-pyridinyl)methyl]-2-methyl-5-oxo-1,6-naphthyridine-3-carboxamide?

6-[(4-chlorophenyl)methyl]-N-[(5-fluoro-2-pyridinyl)methyl]-2-methyl-5-oxo-1,6-naphthyridine-3-carboxamide has a molecular weight of 436.87 g/mol, XLogP of 3.87, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.

Where does this data come from?

All data for 6-[(4-chlorophenyl)methyl]-N-[(5-fluoro-2-pyridinyl)methyl]-2-methyl-5-oxo-1,6-naphthyridine-3-carboxamide is sourced from PubChem (CID 169248867), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).