6-(8-chloroimidazo[1,2-a]pyridin-6-yl)-7-(4-fluorophenyl)-1H-1,8-naphthyridin-2-one

C21H12ClFN4O — CID 154604990

IUPAC6-(8-chloroimidazo[1,2-a]pyridin-6-yl)-7-(4-fluorophenyl)-1H-1,8-naphthyridin-2-one
SMILESO=c1ccc2cc(-c3cc(Cl)c4nccn4c3)c(-c3ccc(F)cc3)nc2[nH]1
InChIInChI=1S/C21H12ClFN4O/c22-17-10-14(11-27-8-7-24-21(17)27)16-9-13-3-6-18(28)25-20(13)26-19(16)12-1-4-15(23)5-2-12/h1-11H,(H,25,26,28)
InChIKeyIJJMWCSDYGGSCT-UHFFFAOYSA-N
MW390.81 g/mol
LogP4.70
Rot. Bonds2

About 6-(8-chloroimidazo[1,2-a]pyridin-6-yl)-7-(4-fluorophenyl)-1H-1,8-naphthyridin-2-one

6-(8-chloroimidazo[1,2-a]pyridin-6-yl)-7-(4-fluorophenyl)-1H-1,8-naphthyridin-2-one (PubChem CID 154604990) has the molecular formula C21H12ClFN4O and a molecular weight of 390.81 g/mol. Its IUPAC name is 6-(8-chloroimidazo[1,2-a]pyridin-6-yl)-7-(4-fluorophenyl)-1H-1,8-naphthyridin-2-one.

Molecular Properties

Compound Name6-(8-chloroimidazo[1,2-a]pyridin-6-yl)-7-(4-fluorophenyl)-1H-1,8-naphthyridin-2-one
PubChem CID154604990
Molecular FormulaC21H12ClFN4O
Molecular Weight390.81 g/mol
Exact Mass390.07
IUPAC Name6-(8-chloroimidazo[1,2-a]pyridin-6-yl)-7-(4-fluorophenyl)-1H-1,8-naphthyridin-2-one
SMILESO=c1ccc2cc(-c3cc(Cl)c4nccn4c3)c(-c3ccc(F)cc3)nc2[nH]1
InChIInChI=1S/C21H12ClFN4O/c22-17-10-14(11-27-8-7-24-21(17)27)16-9-13-3-6-18(28)25-20(13)26-19(16)12-1-4-15(23)5-2-12/h1-11H,(H,25,26,28)
InChIKeyIJJMWCSDYGGSCT-UHFFFAOYSA-N
XLogP4.70
TPSA63.05 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500390.81
LogP ≤ 54.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

Imidazopyridine 18a
CID 5329351
N-(2-Chlorophenyl)-6-(4-piperidinyl)imidazo[1,2-a]pyridine-3-carboxamide
CID 46175113
N-{6-[6-Amino-5-(Trifluoromethyl)pyridin-3-Yl]imidazo[1,2-A]pyridin-2-Yl}acetamide
CID 59251679
N-[4-(3-Chloro-4-fluoro-phenylamino)-pyrido[3,4-d]pyrimidin-6-yl]-acrylamide
CID 10759828
(2-Chlorobenzyl)-{4-[7-dimethylaminomethyl-2-(4-fluorophenyl)imidazo[1,2-a]pyridin-3-yl]pyrimidin-2-yl}amine
CID 24744107
(3-Chlorobenzyl)-{4-[7-dimethylaminomethyl-2-(4-fluorophenyl)imidazo[1,2-a]pyridin-3-yl]pyrimidin-2-yl}amine
CID 24744270
4-[2-(4-Chlorophenyl)-7-dimethylaminomethylimidazo[1,2-a]pyridin-3-yl]pyrimidin-2-ylamine
CID 24745380
(4-Chlorobenzyl)-{4-[7-dimethylaminomethyl-2-(4-fluorophenyl)imidazo[1,2-a]pyridin-3-yl]pyrimidin-2-yl}amine
CID 24745529
N-(3-fluorophenyl)-6-pyridin-2-ylimidazo[1,2-a]pyridine-2-carboxamide
CID 44137900
N-(2,5-difluorophenyl)-6-pyridin-2-ylimidazo[1,2-a]pyridine-2-carboxamide
CID 44137901
N-{4-[7-dimethylaminomethyl-2-(4-fluorophenyl)imidazo[1,2-a]pyridin-3-yl]pyrimidin-2-yl}propionamide
CID 44444862
Cyclopropanecarboxylic acid {4-[7-dimethylaminomethyl-2-(4-fluorophenyl)imidazo[1,2-a]pyridin-3-yl]pyrimidin-2-yl}amide
CID 44444863

Frequently Asked Questions

What is the IUPAC name of 6-(8-chloroimidazo[1,2-a]pyridin-6-yl)-7-(4-fluorophenyl)-1H-1,8-naphthyridin-2-one?
The IUPAC name of 6-(8-chloroimidazo[1,2-a]pyridin-6-yl)-7-(4-fluorophenyl)-1H-1,8-naphthyridin-2-one (CID 154604990) is 6-(8-chloroimidazo[1,2-a]pyridin-6-yl)-7-(4-fluorophenyl)-1H-1,8-naphthyridin-2-one.
What is the SMILES notation for 6-(8-chloroimidazo[1,2-a]pyridin-6-yl)-7-(4-fluorophenyl)-1H-1,8-naphthyridin-2-one?
The canonical SMILES for 6-(8-chloroimidazo[1,2-a]pyridin-6-yl)-7-(4-fluorophenyl)-1H-1,8-naphthyridin-2-one is O=c1ccc2cc(-c3cc(Cl)c4nccn4c3)c(-c3ccc(F)cc3)nc2[nH]1.
What is the InChIKey of 6-(8-chloroimidazo[1,2-a]pyridin-6-yl)-7-(4-fluorophenyl)-1H-1,8-naphthyridin-2-one?
The InChIKey is IJJMWCSDYGGSCT-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H12ClFN4O/c22-17-10-14(11-27-8-7-24-21(17)27)16-9-13-3-6-18(28)25-20(13)26-19(16)12-1-4-15(23)5-2-12/h1-11H,(H,25,26,28).
What are the key properties of 6-(8-chloroimidazo[1,2-a]pyridin-6-yl)-7-(4-fluorophenyl)-1H-1,8-naphthyridin-2-one?
6-(8-chloroimidazo[1,2-a]pyridin-6-yl)-7-(4-fluorophenyl)-1H-1,8-naphthyridin-2-one has a molecular weight of 390.81 g/mol, XLogP of 4.70, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(8-chloroimidazo[1,2-a]pyridin-6-yl)-7-(4-fluorophenyl)-1H-1,8-naphthyridin-2-one is sourced from PubChem (CID 154604990), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).