2-(2H-tetrazol-5-yl)imidazo[1,2-a]pyridine-5-carboxylic acid

C9H6N6O2 — CID 19701356

IUPAC2-(2H-tetrazol-5-yl)imidazo[1,2-a]pyridine-5-carboxylic acid
SMILESO=C(O)c1cccc2nc(-c3nn[nH]n3)cn12
InChIInChI=1S/C9H6N6O2/c16-9(17)6-2-1-3-7-10-5(4-15(6)7)8-11-13-14-12-8/h1-4H,(H,16,17)(H,11,12,13,14)
InChIKeyVJKHUOXFNMDFGO-UHFFFAOYSA-N
MW230.19 g/mol
LogP0.21
Rot. Bonds2

About 2-(2H-tetrazol-5-yl)imidazo[1,2-a]pyridine-5-carboxylic acid

2-(2H-tetrazol-5-yl)imidazo[1,2-a]pyridine-5-carboxylic acid (PubChem CID 19701356) has the molecular formula C9H6N6O2 and a molecular weight of 230.19 g/mol. Its IUPAC name is 2-(2H-tetrazol-5-yl)imidazo[1,2-a]pyridine-5-carboxylic acid.

Molecular Properties

Compound Name2-(2H-tetrazol-5-yl)imidazo[1,2-a]pyridine-5-carboxylic acid
PubChem CID19701356
Molecular FormulaC9H6N6O2
Molecular Weight230.19 g/mol
Exact Mass230.06
IUPAC Name2-(2H-tetrazol-5-yl)imidazo[1,2-a]pyridine-5-carboxylic acid
SMILESO=C(O)c1cccc2nc(-c3nn[nH]n3)cn12
InChIInChI=1S/C9H6N6O2/c16-9(17)6-2-1-3-7-10-5(4-15(6)7)8-11-13-14-12-8/h1-4H,(H,16,17)(H,11,12,13,14)
InChIKeyVJKHUOXFNMDFGO-UHFFFAOYSA-N
XLogP0.21
TPSA109.06 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.19
LogP ≤ 50.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 2-(2H-tetrazol-5-yl)imidazo[1,2-a]pyridine-5-carboxylic acid?
The IUPAC name of 2-(2H-tetrazol-5-yl)imidazo[1,2-a]pyridine-5-carboxylic acid (CID 19701356) is 2-(2H-tetrazol-5-yl)imidazo[1,2-a]pyridine-5-carboxylic acid.
What is the SMILES notation for 2-(2H-tetrazol-5-yl)imidazo[1,2-a]pyridine-5-carboxylic acid?
The canonical SMILES for 2-(2H-tetrazol-5-yl)imidazo[1,2-a]pyridine-5-carboxylic acid is O=C(O)c1cccc2nc(-c3nn[nH]n3)cn12.
What is the InChIKey of 2-(2H-tetrazol-5-yl)imidazo[1,2-a]pyridine-5-carboxylic acid?
The InChIKey is VJKHUOXFNMDFGO-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H6N6O2/c16-9(17)6-2-1-3-7-10-5(4-15(6)7)8-11-13-14-12-8/h1-4H,(H,16,17)(H,11,12,13,14).
What are the key properties of 2-(2H-tetrazol-5-yl)imidazo[1,2-a]pyridine-5-carboxylic acid?
2-(2H-tetrazol-5-yl)imidazo[1,2-a]pyridine-5-carboxylic acid has a molecular weight of 230.19 g/mol, XLogP of 0.21, 2 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2H-tetrazol-5-yl)imidazo[1,2-a]pyridine-5-carboxylic acid is sourced from PubChem (CID 19701356), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).