N-[(3,4-difluorophenyl)methyl]-4-methyl-1-[(5-methylpyrazin-2-yl)methyl]-2-oxopyridine-3-carboxamide

C20H18F2N4O2 — CID 172671574

About N-[(3,4-difluorophenyl)methyl]-4-methyl-1-[(5-methylpyrazin-2-yl)methyl]-2-oxopyridine-3-carboxamide

N-[(3,4-difluorophenyl)methyl]-4-methyl-1-[(5-methylpyrazin-2-yl)methyl]-2-oxopyridine-3-carboxamide (PubChem CID 172671574) has the molecular formula C20H18F2N4O2 and a molecular weight of 384.39 g/mol. Its IUPAC name is N-[(3,4-difluorophenyl)methyl]-4-methyl-1-[(5-methylpyrazin-2-yl)methyl]-2-oxopyridine-3-carboxamide.

Molecular Properties

• Compound Name: N-[(3,4-difluorophenyl)methyl]-4-methyl-1-[(5-methylpyrazin-2-yl)methyl]-2-oxopyridine-3-carboxamide
• PubChem CID: 172671574
• Molecular Formula: C20H18F2N4O2
• Molecular Weight: 384.39 g/mol
• Exact Mass: 384.14
• IUPAC Name: N-[(3,4-difluorophenyl)methyl]-4-methyl-1-[(5-methylpyrazin-2-yl)methyl]-2-oxopyridine-3-carboxamide
• SMILES: Cc1cnc(Cn2ccc(C)c(C(=O)NCc3ccc(F)c(F)c3)c2=O)cn1
• InChI: InChI=1S/C20H18F2N4O2/c1-12-5-6-26(11-15-10-23-13(2)8-24-15)20(28)18(12)19(27)25-9-14-3-4-16(21)17(22)7-14/h3-8,10H,9,11H2,1-2H3,(H,25,27)
• InChIKey: VDPRYJMKOQRXFZ-UHFFFAOYSA-N
• XLogP: 2.51
• TPSA: 76.88 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 5
• Rotatable Bonds: 5
• Heavy Atoms: 28
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	384.39
LogP ≤ 5	2.51
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	5

Frequently Asked Questions

What is the IUPAC name of N-[(3,4-difluorophenyl)methyl]-4-methyl-1-[(5-methylpyrazin-2-yl)methyl]-2-oxopyridine-3-carboxamide?

The IUPAC name of N-[(3,4-difluorophenyl)methyl]-4-methyl-1-[(5-methylpyrazin-2-yl)methyl]-2-oxopyridine-3-carboxamide (CID 172671574) is N-[(3,4-difluorophenyl)methyl]-4-methyl-1-[(5-methylpyrazin-2-yl)methyl]-2-oxopyridine-3-carboxamide.

What is the SMILES notation for N-[(3,4-difluorophenyl)methyl]-4-methyl-1-[(5-methylpyrazin-2-yl)methyl]-2-oxopyridine-3-carboxamide?

The canonical SMILES for N-[(3,4-difluorophenyl)methyl]-4-methyl-1-[(5-methylpyrazin-2-yl)methyl]-2-oxopyridine-3-carboxamide is Cc1cnc(Cn2ccc(C)c(C(=O)NCc3ccc(F)c(F)c3)c2=O)cn1.

What is the InChIKey of N-[(3,4-difluorophenyl)methyl]-4-methyl-1-[(5-methylpyrazin-2-yl)methyl]-2-oxopyridine-3-carboxamide?

The InChIKey is VDPRYJMKOQRXFZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H18F2N4O2/c1-12-5-6-26(11-15-10-23-13(2)8-24-15)20(28)18(12)19(27)25-9-14-3-4-16(21)17(22)7-14/h3-8,10H,9,11H2,1-2H3,(H,25,27).

What are the key properties of N-[(3,4-difluorophenyl)methyl]-4-methyl-1-[(5-methylpyrazin-2-yl)methyl]-2-oxopyridine-3-carboxamide?

N-[(3,4-difluorophenyl)methyl]-4-methyl-1-[(5-methylpyrazin-2-yl)methyl]-2-oxopyridine-3-carboxamide has a molecular weight of 384.39 g/mol, XLogP of 2.51, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.

Where does this data come from?

All data for N-[(3,4-difluorophenyl)methyl]-4-methyl-1-[(5-methylpyrazin-2-yl)methyl]-2-oxopyridine-3-carboxamide is sourced from PubChem (CID 172671574), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).