3-(8-fluoroimidazo[1,2-a]pyridin-2-yl)-7-(3-methylpiperazin-1-yl)pyrano[2,3-b]pyridin-2-one

C20H18FN5O2 — CID 78161665

IUPAC3-(8-fluoroimidazo[1,2-a]pyridin-2-yl)-7-(3-methylpiperazin-1-yl)pyrano[2,3-b]pyridin-2-one
SMILESCC1CN(c2ccc3cc(-c4cn5cccc(F)c5n4)c(=O)oc3n2)CCN1
InChIInChI=1S/C20H18FN5O2/c1-12-10-25(8-6-22-12)17-5-4-13-9-14(20(27)28-19(13)24-17)16-11-26-7-2-3-15(21)18(26)23-16/h2-5,7,9,11-12,22H,6,8,10H2,1H3
InChIKeyGZPYXAMOKAQBMJ-UHFFFAOYSA-N
MW379.40 g/mol
LogP2.44
Rot. Bonds2

About 3-(8-fluoroimidazo[1,2-a]pyridin-2-yl)-7-(3-methylpiperazin-1-yl)pyrano[2,3-b]pyridin-2-one

3-(8-fluoroimidazo[1,2-a]pyridin-2-yl)-7-(3-methylpiperazin-1-yl)pyrano[2,3-b]pyridin-2-one (PubChem CID 78161665) has the molecular formula C20H18FN5O2 and a molecular weight of 379.40 g/mol. Its IUPAC name is 3-(8-fluoroimidazo[1,2-a]pyridin-2-yl)-7-(3-methylpiperazin-1-yl)pyrano[2,3-b]pyridin-2-one.

Molecular Properties

Compound Name3-(8-fluoroimidazo[1,2-a]pyridin-2-yl)-7-(3-methylpiperazin-1-yl)pyrano[2,3-b]pyridin-2-one
PubChem CID78161665
Molecular FormulaC20H18FN5O2
Molecular Weight379.40 g/mol
Exact Mass379.14
IUPAC Name3-(8-fluoroimidazo[1,2-a]pyridin-2-yl)-7-(3-methylpiperazin-1-yl)pyrano[2,3-b]pyridin-2-one
SMILESCC1CN(c2ccc3cc(-c4cn5cccc(F)c5n4)c(=O)oc3n2)CCN1
InChIInChI=1S/C20H18FN5O2/c1-12-10-25(8-6-22-12)17-5-4-13-9-14(20(27)28-19(13)24-17)16-11-26-7-2-3-15(21)18(26)23-16/h2-5,7,9,11-12,22H,6,8,10H2,1H3
InChIKeyGZPYXAMOKAQBMJ-UHFFFAOYSA-N
XLogP2.44
TPSA75.67 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds2
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500379.40
LogP ≤ 52.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Analyze 3-(8-fluoroimidazo[1,2-a]pyridin-2-yl)-7-(3-methylpiperazin-1-yl)pyrano[2,3-b]pyridin-2-one with MolForge

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Related Compounds

(S)-3-(6,8-Dimethylimidazo[1,2-a]pyrazin-2-yl)-7-(3-methylpiperazin-1-yl)-2H-chromen-2-one
CID 89655253
3-(8-Methyl-2-imidazo[1,2-a]pyridinyl)-1-benzopyran-2-one
CID 767302
3-(7-Methylimidazo[1,2-a]pyridin-2-yl)chromen-2-one
CID 830970
3-(imidazo[1,2-a]pyridin-2-yl)-2H-chromen-2-one
CID 397075
3-(Imidazo[1,2-a]pyridin-2-yl)-7-(piperazin-1-yl)-2H-chromen-2-one
CID 71622408
3-(6-Methylimidazo[1,2-a]pyridin-2-yl)-7-piperazin-1-ylchromen-2-one
CID 71622687
3-(6,8-dimethylimidazo[1,2-a]pyrazin-2-yl)-7-[(3R)-3-methylpiperazin-1-yl]chromen-2-one
CID 89654975
7-(4-Tert-butylpiperazin-1-yl)-3-(6,8-dimethylimidazo[1,2-a]pyrazin-2-yl)chromen-2-one
CID 89655966
3-(6-Methylimidazo[1,2-a]pyrazin-2-yl)-7-(piperazin-1-yl)-2h-chromen-2-one
CID 89655987
3-Imidazo[1,2-a]pyrazin-2-yl-7-piperazin-1-ylchromen-2-one
CID 89656703
3-(6,8-dimethylimidazo[1,2-a]pyrazin-2-yl)-7-[(3S)-3,4-dimethylpiperazin-1-yl]chromen-2-one
CID 89656757
3-(2-Methylimidazo[1,2-a]pyridin-6-yl)-7-piperazin-1-ylchromen-2-one
CID 89656891

Frequently Asked Questions

What is the IUPAC name of 3-(8-fluoroimidazo[1,2-a]pyridin-2-yl)-7-(3-methylpiperazin-1-yl)pyrano[2,3-b]pyridin-2-one?
The IUPAC name of 3-(8-fluoroimidazo[1,2-a]pyridin-2-yl)-7-(3-methylpiperazin-1-yl)pyrano[2,3-b]pyridin-2-one (CID 78161665) is 3-(8-fluoroimidazo[1,2-a]pyridin-2-yl)-7-(3-methylpiperazin-1-yl)pyrano[2,3-b]pyridin-2-one.
What is the SMILES notation for 3-(8-fluoroimidazo[1,2-a]pyridin-2-yl)-7-(3-methylpiperazin-1-yl)pyrano[2,3-b]pyridin-2-one?
The canonical SMILES for 3-(8-fluoroimidazo[1,2-a]pyridin-2-yl)-7-(3-methylpiperazin-1-yl)pyrano[2,3-b]pyridin-2-one is CC1CN(c2ccc3cc(-c4cn5cccc(F)c5n4)c(=O)oc3n2)CCN1.
What is the InChIKey of 3-(8-fluoroimidazo[1,2-a]pyridin-2-yl)-7-(3-methylpiperazin-1-yl)pyrano[2,3-b]pyridin-2-one?
The InChIKey is GZPYXAMOKAQBMJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H18FN5O2/c1-12-10-25(8-6-22-12)17-5-4-13-9-14(20(27)28-19(13)24-17)16-11-26-7-2-3-15(21)18(26)23-16/h2-5,7,9,11-12,22H,6,8,10H2,1H3.
What are the key properties of 3-(8-fluoroimidazo[1,2-a]pyridin-2-yl)-7-(3-methylpiperazin-1-yl)pyrano[2,3-b]pyridin-2-one?
3-(8-fluoroimidazo[1,2-a]pyridin-2-yl)-7-(3-methylpiperazin-1-yl)pyrano[2,3-b]pyridin-2-one has a molecular weight of 379.40 g/mol, XLogP of 2.44, 2 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(8-fluoroimidazo[1,2-a]pyridin-2-yl)-7-(3-methylpiperazin-1-yl)pyrano[2,3-b]pyridin-2-one is sourced from PubChem (CID 78161665), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).