N-[5-[2-(2-fluorophenyl)-1,8-naphthyridin-4-yl]-2,6-naphthyridin-1-yl]acetamide

C24H16FN5O — CID 56592379

IUPACN-[5-[2-(2-fluorophenyl)-1,8-naphthyridin-4-yl]-2,6-naphthyridin-1-yl]acetamide
SMILESCC(=O)Nc1nccc2c(-c3cc(-c4ccccc4F)nc4ncccc34)nccc12
InChIInChI=1S/C24H16FN5O/c1-14(31)29-23-17-9-11-26-22(15(17)8-12-28-23)19-13-21(18-5-2-3-7-20(18)25)30-24-16(19)6-4-10-27-24/h2-13H,1H3,(H,28,29,31)
InChIKeyLEFHWJFSINNQFO-UHFFFAOYSA-N
MW409.42 g/mol
LogP5.00
Rot. Bonds3

About N-[5-[2-(2-fluorophenyl)-1,8-naphthyridin-4-yl]-2,6-naphthyridin-1-yl]acetamide

N-[5-[2-(2-fluorophenyl)-1,8-naphthyridin-4-yl]-2,6-naphthyridin-1-yl]acetamide (PubChem CID 56592379) has the molecular formula C24H16FN5O and a molecular weight of 409.42 g/mol. Its IUPAC name is N-[5-[2-(2-fluorophenyl)-1,8-naphthyridin-4-yl]-2,6-naphthyridin-1-yl]acetamide.

Molecular Properties

Compound NameN-[5-[2-(2-fluorophenyl)-1,8-naphthyridin-4-yl]-2,6-naphthyridin-1-yl]acetamide
PubChem CID56592379
Molecular FormulaC24H16FN5O
Molecular Weight409.42 g/mol
Exact Mass409.13
IUPAC NameN-[5-[2-(2-fluorophenyl)-1,8-naphthyridin-4-yl]-2,6-naphthyridin-1-yl]acetamide
SMILESCC(=O)Nc1nccc2c(-c3cc(-c4ccccc4F)nc4ncccc34)nccc12
InChIInChI=1S/C24H16FN5O/c1-14(31)29-23-17-9-11-26-22(15(17)8-12-28-23)19-13-21(18-5-2-3-7-20(18)25)30-24-16(19)6-4-10-27-24/h2-13H,1H3,(H,28,29,31)
InChIKeyLEFHWJFSINNQFO-UHFFFAOYSA-N
XLogP5.00
TPSA80.66 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms31
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500409.42
LogP ≤ 55.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-[5-[2-(2-fluorophenyl)-1,8-naphthyridin-4-yl]-2,6-naphthyridin-1-yl]acetamide?
The IUPAC name of N-[5-[2-(2-fluorophenyl)-1,8-naphthyridin-4-yl]-2,6-naphthyridin-1-yl]acetamide (CID 56592379) is N-[5-[2-(2-fluorophenyl)-1,8-naphthyridin-4-yl]-2,6-naphthyridin-1-yl]acetamide.
What is the SMILES notation for N-[5-[2-(2-fluorophenyl)-1,8-naphthyridin-4-yl]-2,6-naphthyridin-1-yl]acetamide?
The canonical SMILES for N-[5-[2-(2-fluorophenyl)-1,8-naphthyridin-4-yl]-2,6-naphthyridin-1-yl]acetamide is CC(=O)Nc1nccc2c(-c3cc(-c4ccccc4F)nc4ncccc34)nccc12.
What is the InChIKey of N-[5-[2-(2-fluorophenyl)-1,8-naphthyridin-4-yl]-2,6-naphthyridin-1-yl]acetamide?
The InChIKey is LEFHWJFSINNQFO-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H16FN5O/c1-14(31)29-23-17-9-11-26-22(15(17)8-12-28-23)19-13-21(18-5-2-3-7-20(18)25)30-24-16(19)6-4-10-27-24/h2-13H,1H3,(H,28,29,31).
What are the key properties of N-[5-[2-(2-fluorophenyl)-1,8-naphthyridin-4-yl]-2,6-naphthyridin-1-yl]acetamide?
N-[5-[2-(2-fluorophenyl)-1,8-naphthyridin-4-yl]-2,6-naphthyridin-1-yl]acetamide has a molecular weight of 409.42 g/mol, XLogP of 5.00, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-[2-(2-fluorophenyl)-1,8-naphthyridin-4-yl]-2,6-naphthyridin-1-yl]acetamide is sourced from PubChem (CID 56592379), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).