5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-2,7-dicarboxylic acid

C9H10N2O4 — CID 83966379

IUPAC5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-2,7-dicarboxylic acid
SMILESO=C(O)c1cn2c(n1)CC(C(=O)O)CC2
InChIInChI=1S/C9H10N2O4/c12-8(13)5-1-2-11-4-6(9(14)15)10-7(11)3-5/h4-5H,1-3H2,(H,12,13)(H,14,15)
InChIKeyDSCXJGREWSPQTK-UHFFFAOYSA-N
MW210.19 g/mol
LogP0.23
Rot. Bonds2

About 5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-2,7-dicarboxylic acid

5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-2,7-dicarboxylic acid (PubChem CID 83966379) has the molecular formula C9H10N2O4 and a molecular weight of 210.19 g/mol. Its IUPAC name is 5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-2,7-dicarboxylic acid.

Molecular Properties

Compound Name5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-2,7-dicarboxylic acid
PubChem CID83966379
Molecular FormulaC9H10N2O4
Molecular Weight210.19 g/mol
Exact Mass210.06
IUPAC Name5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-2,7-dicarboxylic acid
SMILESO=C(O)c1cn2c(n1)CC(C(=O)O)CC2
InChIInChI=1S/C9H10N2O4/c12-8(13)5-1-2-11-4-6(9(14)15)10-7(11)3-5/h4-5H,1-3H2,(H,12,13)(H,14,15)
InChIKeyDSCXJGREWSPQTK-UHFFFAOYSA-N
XLogP0.23
TPSA92.42 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.19
LogP ≤ 50.23
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-7-carboxylic acid;hydrochloride
CID 126796985
(7S)-2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-7-carboxylic acid
CID 125454335
2-(thian-4-ylmethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-7-carboxylic acid
CID 117155945
2-(furan-2-yl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-7-carboxylic acid
CID 83966369
2-piperidin-3-yl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-7-carboxylic acid
CID 117155961
2-(4-methoxy-2-methylphenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-7-carboxylic acid
CID 83966376
lithium;6,7-dihydro-5H-pyrrolo[1,2-a]imidazole-2-carboxylic acid;hydride
CID 174674138
(5S)-5-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-2-carboxylic acid
CID 124510180
2-cyclopropyl-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridine-7-carboxylic acid
CID 82567811
5,8-dihydroimidazo[1,2-a]pyrazine-2-carboxylic acid
CID 176761340
6-cyclopentyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyrazine-2-carboxylic acid
CID 167414141
2-phenyl-6,7-dihydro-5H-pyrrolo[1,2-a]imidazole-6-carboxylic acid
CID 82391245

Frequently Asked Questions

What is the IUPAC name of 5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-2,7-dicarboxylic acid?
The IUPAC name of 5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-2,7-dicarboxylic acid (CID 83966379) is 5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-2,7-dicarboxylic acid.
What is the SMILES notation for 5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-2,7-dicarboxylic acid?
The canonical SMILES for 5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-2,7-dicarboxylic acid is O=C(O)c1cn2c(n1)CC(C(=O)O)CC2.
What is the InChIKey of 5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-2,7-dicarboxylic acid?
The InChIKey is DSCXJGREWSPQTK-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10N2O4/c12-8(13)5-1-2-11-4-6(9(14)15)10-7(11)3-5/h4-5H,1-3H2,(H,12,13)(H,14,15).
What are the key properties of 5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-2,7-dicarboxylic acid?
5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-2,7-dicarboxylic acid has a molecular weight of 210.19 g/mol, XLogP of 0.23, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-2,7-dicarboxylic acid is sourced from PubChem (CID 83966379), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).