7-methyl-3-phenylimidazo[1,2-a]pyridine-2-carboxylic acid

C15H12N2O2 — CID 82063200

IUPAC7-methyl-3-phenylimidazo[1,2-a]pyridine-2-carboxylic acid
SMILESCc1ccn2c(-c3ccccc3)c(C(=O)O)nc2c1
InChIInChI=1S/C15H12N2O2/c1-10-7-8-17-12(9-10)16-13(15(18)19)14(17)11-5-3-2-4-6-11/h2-9H,1H3,(H,18,19)
InChIKeyNYOVPRCTMFKRQJ-UHFFFAOYSA-N
MW252.27 g/mol
LogP3.01
Rot. Bonds2

About 7-methyl-3-phenylimidazo[1,2-a]pyridine-2-carboxylic acid

7-methyl-3-phenylimidazo[1,2-a]pyridine-2-carboxylic acid (PubChem CID 82063200) has the molecular formula C15H12N2O2 and a molecular weight of 252.27 g/mol. Its IUPAC name is 7-methyl-3-phenylimidazo[1,2-a]pyridine-2-carboxylic acid.

Molecular Properties

Compound Name7-methyl-3-phenylimidazo[1,2-a]pyridine-2-carboxylic acid
PubChem CID82063200
Molecular FormulaC15H12N2O2
Molecular Weight252.27 g/mol
Exact Mass252.09
IUPAC Name7-methyl-3-phenylimidazo[1,2-a]pyridine-2-carboxylic acid
SMILESCc1ccn2c(-c3ccccc3)c(C(=O)O)nc2c1
InChIInChI=1S/C15H12N2O2/c1-10-7-8-17-12(9-10)16-13(15(18)19)14(17)11-5-3-2-4-6-11/h2-9H,1H3,(H,18,19)
InChIKeyNYOVPRCTMFKRQJ-UHFFFAOYSA-N
XLogP3.01
TPSA54.60 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.27
LogP ≤ 53.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 7-methyl-3-phenylimidazo[1,2-a]pyridine-2-carboxylic acid?
The IUPAC name of 7-methyl-3-phenylimidazo[1,2-a]pyridine-2-carboxylic acid (CID 82063200) is 7-methyl-3-phenylimidazo[1,2-a]pyridine-2-carboxylic acid.
What is the SMILES notation for 7-methyl-3-phenylimidazo[1,2-a]pyridine-2-carboxylic acid?
The canonical SMILES for 7-methyl-3-phenylimidazo[1,2-a]pyridine-2-carboxylic acid is Cc1ccn2c(-c3ccccc3)c(C(=O)O)nc2c1.
What is the InChIKey of 7-methyl-3-phenylimidazo[1,2-a]pyridine-2-carboxylic acid?
The InChIKey is NYOVPRCTMFKRQJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12N2O2/c1-10-7-8-17-12(9-10)16-13(15(18)19)14(17)11-5-3-2-4-6-11/h2-9H,1H3,(H,18,19).
What are the key properties of 7-methyl-3-phenylimidazo[1,2-a]pyridine-2-carboxylic acid?
7-methyl-3-phenylimidazo[1,2-a]pyridine-2-carboxylic acid has a molecular weight of 252.27 g/mol, XLogP of 3.01, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 7-methyl-3-phenylimidazo[1,2-a]pyridine-2-carboxylic acid is sourced from PubChem (CID 82063200), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).