6-anilinoimidazo[1,2-a]pyridine-2-carboxylic acid

C14H11N3O2 — CID 138634473

IUPAC6-anilinoimidazo[1,2-a]pyridine-2-carboxylic acid
SMILESO=C(O)c1cn2cc(Nc3ccccc3)ccc2n1
InChIInChI=1S/C14H11N3O2/c18-14(19)12-9-17-8-11(6-7-13(17)16-12)15-10-4-2-1-3-5-10/h1-9,15H,(H,18,19)
InChIKeyBVLCSUZXSKPMLC-UHFFFAOYSA-N
MW253.26 g/mol
LogP2.78
Rot. Bonds3

About 6-anilinoimidazo[1,2-a]pyridine-2-carboxylic acid

6-anilinoimidazo[1,2-a]pyridine-2-carboxylic acid (PubChem CID 138634473) has the molecular formula C14H11N3O2 and a molecular weight of 253.26 g/mol. Its IUPAC name is 6-anilinoimidazo[1,2-a]pyridine-2-carboxylic acid.

Molecular Properties

Compound Name6-anilinoimidazo[1,2-a]pyridine-2-carboxylic acid
PubChem CID138634473
Molecular FormulaC14H11N3O2
Molecular Weight253.26 g/mol
Exact Mass253.09
IUPAC Name6-anilinoimidazo[1,2-a]pyridine-2-carboxylic acid
SMILESO=C(O)c1cn2cc(Nc3ccccc3)ccc2n1
InChIInChI=1S/C14H11N3O2/c18-14(19)12-9-17-8-11(6-7-13(17)16-12)15-10-4-2-1-3-5-10/h1-9,15H,(H,18,19)
InChIKeyBVLCSUZXSKPMLC-UHFFFAOYSA-N
XLogP2.78
TPSA66.63 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.26
LogP ≤ 52.78
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-anilinoimidazo[1,2-a]pyridine-2-carboxylic acid?
The IUPAC name of 6-anilinoimidazo[1,2-a]pyridine-2-carboxylic acid (CID 138634473) is 6-anilinoimidazo[1,2-a]pyridine-2-carboxylic acid.
What is the SMILES notation for 6-anilinoimidazo[1,2-a]pyridine-2-carboxylic acid?
The canonical SMILES for 6-anilinoimidazo[1,2-a]pyridine-2-carboxylic acid is O=C(O)c1cn2cc(Nc3ccccc3)ccc2n1.
What is the InChIKey of 6-anilinoimidazo[1,2-a]pyridine-2-carboxylic acid?
The InChIKey is BVLCSUZXSKPMLC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11N3O2/c18-14(19)12-9-17-8-11(6-7-13(17)16-12)15-10-4-2-1-3-5-10/h1-9,15H,(H,18,19).
What are the key properties of 6-anilinoimidazo[1,2-a]pyridine-2-carboxylic acid?
6-anilinoimidazo[1,2-a]pyridine-2-carboxylic acid has a molecular weight of 253.26 g/mol, XLogP of 2.78, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-anilinoimidazo[1,2-a]pyridine-2-carboxylic acid is sourced from PubChem (CID 138634473), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).