5-fluoro-N-[(3-methyl-5,6,7,8-tetrahydro-2,7-naphthyridin-4-yl)methyl]-1H-indole-2-carboxamide

C19H19FN4O — CID 56891334

About 5-fluoro-N-[(3-methyl-5,6,7,8-tetrahydro-2,7-naphthyridin-4-yl)methyl]-1H-indole-2-carboxamide

5-fluoro-N-[(3-methyl-5,6,7,8-tetrahydro-2,7-naphthyridin-4-yl)methyl]-1H-indole-2-carboxamide (PubChem CID 56891334) has the molecular formula C19H19FN4O and a molecular weight of 338.39 g/mol. Its IUPAC name is 5-fluoro-N-[(3-methyl-5,6,7,8-tetrahydro-2,7-naphthyridin-4-yl)methyl]-1H-indole-2-carboxamide.

Molecular Properties

• Compound Name: 5-fluoro-N-[(3-methyl-5,6,7,8-tetrahydro-2,7-naphthyridin-4-yl)methyl]-1H-indole-2-carboxamide
• PubChem CID: 56891334
• Molecular Formula: C19H19FN4O
• Molecular Weight: 338.39 g/mol
• Exact Mass: 338.15
• IUPAC Name: 5-fluoro-N-[(3-methyl-5,6,7,8-tetrahydro-2,7-naphthyridin-4-yl)methyl]-1H-indole-2-carboxamide
• SMILES: Cc1ncc2c(c1CNC(=O)c1cc3cc(F)ccc3[nH]1)CCNC2
• InChI: InChI=1S/C19H19FN4O/c1-11-16(15-4-5-21-8-13(15)9-22-11)10-23-19(25)18-7-12-6-14(20)2-3-17(12)24-18/h2-3,6-7,9,21,24H,4-5,8,10H2,1H3,(H,23,25)
• InChIKey: LEIVHPRPJMSTJI-UHFFFAOYSA-N
• XLogP: 2.59
• TPSA: 69.81 Ų
• H-Bond Donors: 3
• H-Bond Acceptors: 3
• Rotatable Bonds: 3
• Heavy Atoms: 25
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	338.39
LogP ≤ 5	2.59
H-Bond Donors ≤ 5	3
H-Bond Acceptors ≤ 10	3

Frequently Asked Questions

What is the IUPAC name of 5-fluoro-N-[(3-methyl-5,6,7,8-tetrahydro-2,7-naphthyridin-4-yl)methyl]-1H-indole-2-carboxamide?

The IUPAC name of 5-fluoro-N-[(3-methyl-5,6,7,8-tetrahydro-2,7-naphthyridin-4-yl)methyl]-1H-indole-2-carboxamide (CID 56891334) is 5-fluoro-N-[(3-methyl-5,6,7,8-tetrahydro-2,7-naphthyridin-4-yl)methyl]-1H-indole-2-carboxamide.

What is the SMILES notation for 5-fluoro-N-[(3-methyl-5,6,7,8-tetrahydro-2,7-naphthyridin-4-yl)methyl]-1H-indole-2-carboxamide?

The canonical SMILES for 5-fluoro-N-[(3-methyl-5,6,7,8-tetrahydro-2,7-naphthyridin-4-yl)methyl]-1H-indole-2-carboxamide is Cc1ncc2c(c1CNC(=O)c1cc3cc(F)ccc3[nH]1)CCNC2.

What is the InChIKey of 5-fluoro-N-[(3-methyl-5,6,7,8-tetrahydro-2,7-naphthyridin-4-yl)methyl]-1H-indole-2-carboxamide?

The InChIKey is LEIVHPRPJMSTJI-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19FN4O/c1-11-16(15-4-5-21-8-13(15)9-22-11)10-23-19(25)18-7-12-6-14(20)2-3-17(12)24-18/h2-3,6-7,9,21,24H,4-5,8,10H2,1H3,(H,23,25).

What are the key properties of 5-fluoro-N-[(3-methyl-5,6,7,8-tetrahydro-2,7-naphthyridin-4-yl)methyl]-1H-indole-2-carboxamide?

5-fluoro-N-[(3-methyl-5,6,7,8-tetrahydro-2,7-naphthyridin-4-yl)methyl]-1H-indole-2-carboxamide has a molecular weight of 338.39 g/mol, XLogP of 2.59, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.

Where does this data come from?

All data for 5-fluoro-N-[(3-methyl-5,6,7,8-tetrahydro-2,7-naphthyridin-4-yl)methyl]-1H-indole-2-carboxamide is sourced from PubChem (CID 56891334), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).