6-[(8-fluoro-6-thiophen-3-ylimidazo[1,2-a]pyridin-3-yl)methyl]quinoline

C21H14FN3S — CID 122179433

IUPAC6-[(8-fluoro-6-thiophen-3-ylimidazo[1,2-a]pyridin-3-yl)methyl]quinoline
SMILESFc1cc(-c2ccsc2)cn2c(Cc3ccc4ncccc4c3)cnc12
InChIInChI=1S/C21H14FN3S/c22-19-10-17(16-5-7-26-13-16)12-25-18(11-24-21(19)25)9-14-3-4-20-15(8-14)2-1-6-23-20/h1-8,10-13H,9H2
InChIKeyYAKWNNPRZYJPDP-UHFFFAOYSA-N
MW359.43 g/mol
LogP5.34
Rot. Bonds3

About 6-[(8-fluoro-6-thiophen-3-ylimidazo[1,2-a]pyridin-3-yl)methyl]quinoline

6-[(8-fluoro-6-thiophen-3-ylimidazo[1,2-a]pyridin-3-yl)methyl]quinoline (PubChem CID 122179433) has the molecular formula C21H14FN3S and a molecular weight of 359.43 g/mol. Its IUPAC name is 6-[(8-fluoro-6-thiophen-3-ylimidazo[1,2-a]pyridin-3-yl)methyl]quinoline.

Molecular Properties

Compound Name6-[(8-fluoro-6-thiophen-3-ylimidazo[1,2-a]pyridin-3-yl)methyl]quinoline
PubChem CID122179433
Molecular FormulaC21H14FN3S
Molecular Weight359.43 g/mol
Exact Mass359.09
IUPAC Name6-[(8-fluoro-6-thiophen-3-ylimidazo[1,2-a]pyridin-3-yl)methyl]quinoline
SMILESFc1cc(-c2ccsc2)cn2c(Cc3ccc4ncccc4c3)cnc12
InChIInChI=1S/C21H14FN3S/c22-19-10-17(16-5-7-26-13-16)12-25-18(11-24-21(19)25)9-14-3-4-20-15(8-14)2-1-6-23-20/h1-8,10-13H,9H2
InChIKeyYAKWNNPRZYJPDP-UHFFFAOYSA-N
XLogP5.34
TPSA30.19 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500359.43
LogP ≤ 55.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

Imidazopyridine 10e
CID 5329344
(R)-2-(2-methylimidazo[1,2-a]pyridin-3-yl)-6-(2-(2-methylpyrrolidin-1-yl)ethyl)quinoline
CID 11710453
7-[7-[4-(4-Methylpiperazin-1-yl)phenyl]imidazo[1,2-a]pyridin-3-yl]thieno[2,3-b]pyrazine
CID 56973462
6-Methyl-2-[5-(2-pyridinyl)-2-thienyl]imidazo[1,2-a]pyridine
CID 2813457
2-thiophen-2-yl-3H-imidazo[4,5-c]quinoline
CID 10705898
2-Thiophen-2-ylimidazo[2,1-a]isoquinoline
CID 763549
N-benzyl-6-methyl-2-thiophen-2-ylimidazo[1,2-a]pyridin-3-amine
CID 808829
(2-Imidazol-1-yl-quinazolin-4-yl)-thiophen-2-ylmethyl-amine
CID 9995367
4-thiophen-2-yl-6-(trifluoromethyl)-2-(4-(3-(trifluoromethyl)-pyridin-2-yl)piperazin-1-yl)-1H-benzo[d]imidazole
CID 11498144
2-[[1-[4,4-Bis(4-fluorophenyl)butyl]piperidin-4-yl]methyl]-3-(thiophen-2-ylmethyl)imidazo[4,5-b]pyridine
CID 14013470
2-N-(4-aminocyclohexyl)-9-propan-2-yl-6-N-[(6-thiophen-3-yl-3-pyridinyl)methyl]purine-2,6-diamine
CID 21362604
5-[8-fluoro-3-[(1R)-1-fluoro-1-quinolin-6-ylethyl]-[1,2,4]triazolo[4,3-a]pyridin-6-yl]-3-methyl-1,2-thiazole
CID 44180935

Frequently Asked Questions

What is the IUPAC name of 6-[(8-fluoro-6-thiophen-3-ylimidazo[1,2-a]pyridin-3-yl)methyl]quinoline?
The IUPAC name of 6-[(8-fluoro-6-thiophen-3-ylimidazo[1,2-a]pyridin-3-yl)methyl]quinoline (CID 122179433) is 6-[(8-fluoro-6-thiophen-3-ylimidazo[1,2-a]pyridin-3-yl)methyl]quinoline.
What is the SMILES notation for 6-[(8-fluoro-6-thiophen-3-ylimidazo[1,2-a]pyridin-3-yl)methyl]quinoline?
The canonical SMILES for 6-[(8-fluoro-6-thiophen-3-ylimidazo[1,2-a]pyridin-3-yl)methyl]quinoline is Fc1cc(-c2ccsc2)cn2c(Cc3ccc4ncccc4c3)cnc12.
What is the InChIKey of 6-[(8-fluoro-6-thiophen-3-ylimidazo[1,2-a]pyridin-3-yl)methyl]quinoline?
The InChIKey is YAKWNNPRZYJPDP-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H14FN3S/c22-19-10-17(16-5-7-26-13-16)12-25-18(11-24-21(19)25)9-14-3-4-20-15(8-14)2-1-6-23-20/h1-8,10-13H,9H2.
What are the key properties of 6-[(8-fluoro-6-thiophen-3-ylimidazo[1,2-a]pyridin-3-yl)methyl]quinoline?
6-[(8-fluoro-6-thiophen-3-ylimidazo[1,2-a]pyridin-3-yl)methyl]quinoline has a molecular weight of 359.43 g/mol, XLogP of 5.34, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[(8-fluoro-6-thiophen-3-ylimidazo[1,2-a]pyridin-3-yl)methyl]quinoline is sourced from PubChem (CID 122179433), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).