8-[2-(dimethylamino)ethoxy]-6-fluoroimidazo[1,2-a]pyridine-2-carboxylic acid

C12H14FN3O3 — CID 154436482

IUPAC8-[2-(dimethylamino)ethoxy]-6-fluoroimidazo[1,2-a]pyridine-2-carboxylic acid
SMILESCN(C)CCOc1cc(F)cn2cc(C(=O)O)nc12
InChIInChI=1S/C12H14FN3O3/c1-15(2)3-4-19-10-5-8(13)6-16-7-9(12(17)18)14-11(10)16/h5-7H,3-4H2,1-2H3,(H,17,18)
InChIKeyFQYZPTUILFAATA-UHFFFAOYSA-N
MW267.26 g/mol
LogP1.11
Rot. Bonds5

About 8-[2-(dimethylamino)ethoxy]-6-fluoroimidazo[1,2-a]pyridine-2-carboxylic acid

8-[2-(dimethylamino)ethoxy]-6-fluoroimidazo[1,2-a]pyridine-2-carboxylic acid (PubChem CID 154436482) has the molecular formula C12H14FN3O3 and a molecular weight of 267.26 g/mol. Its IUPAC name is 8-[2-(dimethylamino)ethoxy]-6-fluoroimidazo[1,2-a]pyridine-2-carboxylic acid.

Molecular Properties

Compound Name8-[2-(dimethylamino)ethoxy]-6-fluoroimidazo[1,2-a]pyridine-2-carboxylic acid
PubChem CID154436482
Molecular FormulaC12H14FN3O3
Molecular Weight267.26 g/mol
Exact Mass267.10
IUPAC Name8-[2-(dimethylamino)ethoxy]-6-fluoroimidazo[1,2-a]pyridine-2-carboxylic acid
SMILESCN(C)CCOc1cc(F)cn2cc(C(=O)O)nc12
InChIInChI=1S/C12H14FN3O3/c1-15(2)3-4-19-10-5-8(13)6-16-7-9(12(17)18)14-11(10)16/h5-7H,3-4H2,1-2H3,(H,17,18)
InChIKeyFQYZPTUILFAATA-UHFFFAOYSA-N
XLogP1.11
TPSA67.07 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.26
LogP ≤ 51.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 8-[2-(dimethylamino)ethoxy]-6-fluoroimidazo[1,2-a]pyridine-2-carboxylic acid?
The IUPAC name of 8-[2-(dimethylamino)ethoxy]-6-fluoroimidazo[1,2-a]pyridine-2-carboxylic acid (CID 154436482) is 8-[2-(dimethylamino)ethoxy]-6-fluoroimidazo[1,2-a]pyridine-2-carboxylic acid.
What is the SMILES notation for 8-[2-(dimethylamino)ethoxy]-6-fluoroimidazo[1,2-a]pyridine-2-carboxylic acid?
The canonical SMILES for 8-[2-(dimethylamino)ethoxy]-6-fluoroimidazo[1,2-a]pyridine-2-carboxylic acid is CN(C)CCOc1cc(F)cn2cc(C(=O)O)nc12.
What is the InChIKey of 8-[2-(dimethylamino)ethoxy]-6-fluoroimidazo[1,2-a]pyridine-2-carboxylic acid?
The InChIKey is FQYZPTUILFAATA-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14FN3O3/c1-15(2)3-4-19-10-5-8(13)6-16-7-9(12(17)18)14-11(10)16/h5-7H,3-4H2,1-2H3,(H,17,18).
What are the key properties of 8-[2-(dimethylamino)ethoxy]-6-fluoroimidazo[1,2-a]pyridine-2-carboxylic acid?
8-[2-(dimethylamino)ethoxy]-6-fluoroimidazo[1,2-a]pyridine-2-carboxylic acid has a molecular weight of 267.26 g/mol, XLogP of 1.11, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 8-[2-(dimethylamino)ethoxy]-6-fluoroimidazo[1,2-a]pyridine-2-carboxylic acid is sourced from PubChem (CID 154436482), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).