N-(7-amino-1,8-naphthyridin-2-yl)-2-methyl-4-[(E)-3,3,3-trifluoroprop-1-enyl]benzamide

C19H15F3N4O — CID 143533156

About N-(7-amino-1,8-naphthyridin-2-yl)-2-methyl-4-[(E)-3,3,3-trifluoroprop-1-enyl]benzamide

N-(7-amino-1,8-naphthyridin-2-yl)-2-methyl-4-[(E)-3,3,3-trifluoroprop-1-enyl]benzamide (PubChem CID 143533156) has the molecular formula C19H15F3N4O and a molecular weight of 372.35 g/mol. Its IUPAC name is N-(7-amino-1,8-naphthyridin-2-yl)-2-methyl-4-[(E)-3,3,3-trifluoroprop-1-enyl]benzamide.

Molecular Properties

• Compound Name: N-(7-amino-1,8-naphthyridin-2-yl)-2-methyl-4-[(E)-3,3,3-trifluoroprop-1-enyl]benzamide
• PubChem CID: 143533156
• Molecular Formula: C19H15F3N4O
• Molecular Weight: 372.35 g/mol
• Exact Mass: 372.12
• IUPAC Name: N-(7-amino-1,8-naphthyridin-2-yl)-2-methyl-4-[(E)-3,3,3-trifluoroprop-1-enyl]benzamide
• SMILES: Cc1cc(/C=C/C(F)(F)F)ccc1C(=O)Nc1ccc2ccc(N)nc2n1
• InChI: InChI=1S/C19H15F3N4O/c1-11-10-12(8-9-19(20,21)22)2-5-14(11)18(27)26-16-7-4-13-3-6-15(23)24-17(13)25-16/h2-10H,1H3,(H3,23,24,25,26,27)/b9-8+
• InChIKey: WIZNYBARILZOJW-CMDGGOBGSA-N
• XLogP: 4.35
• TPSA: 80.90 Ų
• H-Bond Donors: 2
• H-Bond Acceptors: 4
• Rotatable Bonds: 3
• Heavy Atoms: 27
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	372.35
LogP ≤ 5	4.35
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	4

Frequently Asked Questions

What is the IUPAC name of N-(7-amino-1,8-naphthyridin-2-yl)-2-methyl-4-[(E)-3,3,3-trifluoroprop-1-enyl]benzamide?

The IUPAC name of N-(7-amino-1,8-naphthyridin-2-yl)-2-methyl-4-[(E)-3,3,3-trifluoroprop-1-enyl]benzamide (CID 143533156) is N-(7-amino-1,8-naphthyridin-2-yl)-2-methyl-4-[(E)-3,3,3-trifluoroprop-1-enyl]benzamide.

What is the SMILES notation for N-(7-amino-1,8-naphthyridin-2-yl)-2-methyl-4-[(E)-3,3,3-trifluoroprop-1-enyl]benzamide?

The canonical SMILES for N-(7-amino-1,8-naphthyridin-2-yl)-2-methyl-4-[(E)-3,3,3-trifluoroprop-1-enyl]benzamide is Cc1cc(/C=C/C(F)(F)F)ccc1C(=O)Nc1ccc2ccc(N)nc2n1.

What is the InChIKey of N-(7-amino-1,8-naphthyridin-2-yl)-2-methyl-4-[(E)-3,3,3-trifluoroprop-1-enyl]benzamide?

The InChIKey is WIZNYBARILZOJW-CMDGGOBGSA-N. The full InChI is InChI=1S/C19H15F3N4O/c1-11-10-12(8-9-19(20,21)22)2-5-14(11)18(27)26-16-7-4-13-3-6-15(23)24-17(13)25-16/h2-10H,1H3,(H3,23,24,25,26,27)/b9-8+.

What are the key properties of N-(7-amino-1,8-naphthyridin-2-yl)-2-methyl-4-[(E)-3,3,3-trifluoroprop-1-enyl]benzamide?

N-(7-amino-1,8-naphthyridin-2-yl)-2-methyl-4-[(E)-3,3,3-trifluoroprop-1-enyl]benzamide has a molecular weight of 372.35 g/mol, XLogP of 4.35, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.

Where does this data come from?

All data for N-(7-amino-1,8-naphthyridin-2-yl)-2-methyl-4-[(E)-3,3,3-trifluoroprop-1-enyl]benzamide is sourced from PubChem (CID 143533156), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).