3-(5-fluoroquinolin-8-yl)imidazo[1,2-a]pyridine-2-carboxylic acid

C17H10FN3O2 — CID 122558194

IUPAC3-(5-fluoroquinolin-8-yl)imidazo[1,2-a]pyridine-2-carboxylic acid
SMILESO=C(O)c1nc2ccccn2c1-c1ccc(F)c2cccnc12
InChIInChI=1S/C17H10FN3O2/c18-12-7-6-11(14-10(12)4-3-8-19-14)16-15(17(22)23)20-13-5-1-2-9-21(13)16/h1-9H,(H,22,23)
InChIKeyKAYIWYLRCPYLDS-UHFFFAOYSA-N
MW307.28 g/mol
LogP3.39
Rot. Bonds2

About 3-(5-fluoroquinolin-8-yl)imidazo[1,2-a]pyridine-2-carboxylic acid

3-(5-fluoroquinolin-8-yl)imidazo[1,2-a]pyridine-2-carboxylic acid (PubChem CID 122558194) has the molecular formula C17H10FN3O2 and a molecular weight of 307.28 g/mol. Its IUPAC name is 3-(5-fluoroquinolin-8-yl)imidazo[1,2-a]pyridine-2-carboxylic acid.

Molecular Properties

Compound Name3-(5-fluoroquinolin-8-yl)imidazo[1,2-a]pyridine-2-carboxylic acid
PubChem CID122558194
Molecular FormulaC17H10FN3O2
Molecular Weight307.28 g/mol
Exact Mass307.08
IUPAC Name3-(5-fluoroquinolin-8-yl)imidazo[1,2-a]pyridine-2-carboxylic acid
SMILESO=C(O)c1nc2ccccn2c1-c1ccc(F)c2cccnc12
InChIInChI=1S/C17H10FN3O2/c18-12-7-6-11(14-10(12)4-3-8-19-14)16-15(17(22)23)20-13-5-1-2-9-21(13)16/h1-9H,(H,22,23)
InChIKeyKAYIWYLRCPYLDS-UHFFFAOYSA-N
XLogP3.39
TPSA67.49 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.28
LogP ≤ 53.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-(5-Pyridin-4-ylimidazo[4,5-b]pyridin-3-yl)benzoic acid
CID 146315981
1-[(2,5-difluorophenyl)methyl]-3-(2,4-dioxo-1H-pteridin-3-yl)-5-(trifluoromethyl)indole-2-carboxylic acid
CID 56661910
4-[4-(2-Butyl-5,7-dimethyl-imidazo[4,5-b]pyridin-3-ylmethyl)-phenyl]-quinoline-3-carboxylic acid
CID 11167180
4-[4-(2-Ethyl-5,7-dimethyl-imidazo[4,5-b]pyridin-3-ylmethyl)-phenyl]-quinoline-3-carboxylic acid
CID 11316515
4-(4-((5,7-dimethyl-2-propyl-3H-imidazo[4,5-b]pyridin-3-yl)methyl)phenyl)-2-methylquinoline-3-carboxylic acid
CID 11328757
2-Amino-4-[4-(2-butyl-5,7-dimethyl-imidazo[4,5-b]pyridin-3-ylmethyl)-phenyl]-quinoline-3-carboxylic acid
CID 11340575
4-[4-(2-Ethyl-5,7-dimethyl-imidazo[4,5-b]pyridin-3-ylmethyl)-phenyl]-2-methylamino-quinoline-3-carboxylic acid
CID 11351776
4-[4-(5,7-Dimethyl-2-propyl-imidazo[4,5-b]pyridin-3-ylmethyl)-phenyl]-quinoline-3-carboxylic acid
CID 11374350
2-Dimethylamino-4-[4-(2-ethyl-5,7-dimethyl-imidazo[4,5-b]pyridin-3-ylmethyl)-phenyl]-quinoline-3-carboxylic acid
CID 11442998
2-Amino-4-[4-(2-ethyl-5,7-dimethyl-imidazo[4,5-b]pyridin-3-ylmethyl)-phenyl]-quinoline-3-carboxylic acid
CID 11476484
2-Dipropylamino-4-[4-(2-ethyl-5,7-dimethyl-imidazo[4,5-b]pyridin-3-ylmethyl)-phenyl]-quinoline-3-carboxylic acid
CID 11785963
8,9-Dioxo-3,11,17-triazatetracyclo[8.7.0.02,7.011,16]heptadeca-1(10),2(7),3,5,12,14,16-heptaene-15-carboxylic acid
CID 16126454

Frequently Asked Questions

What is the IUPAC name of 3-(5-fluoroquinolin-8-yl)imidazo[1,2-a]pyridine-2-carboxylic acid?
The IUPAC name of 3-(5-fluoroquinolin-8-yl)imidazo[1,2-a]pyridine-2-carboxylic acid (CID 122558194) is 3-(5-fluoroquinolin-8-yl)imidazo[1,2-a]pyridine-2-carboxylic acid.
What is the SMILES notation for 3-(5-fluoroquinolin-8-yl)imidazo[1,2-a]pyridine-2-carboxylic acid?
The canonical SMILES for 3-(5-fluoroquinolin-8-yl)imidazo[1,2-a]pyridine-2-carboxylic acid is O=C(O)c1nc2ccccn2c1-c1ccc(F)c2cccnc12.
What is the InChIKey of 3-(5-fluoroquinolin-8-yl)imidazo[1,2-a]pyridine-2-carboxylic acid?
The InChIKey is KAYIWYLRCPYLDS-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H10FN3O2/c18-12-7-6-11(14-10(12)4-3-8-19-14)16-15(17(22)23)20-13-5-1-2-9-21(13)16/h1-9H,(H,22,23).
What are the key properties of 3-(5-fluoroquinolin-8-yl)imidazo[1,2-a]pyridine-2-carboxylic acid?
3-(5-fluoroquinolin-8-yl)imidazo[1,2-a]pyridine-2-carboxylic acid has a molecular weight of 307.28 g/mol, XLogP of 3.39, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(5-fluoroquinolin-8-yl)imidazo[1,2-a]pyridine-2-carboxylic acid is sourced from PubChem (CID 122558194), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).