2-(N-methylanilino)imidazo[1,2-a]pyridine-3-carboxylic acid

C15H13N3O2 — CID 43477811

IUPAC2-(N-methylanilino)imidazo[1,2-a]pyridine-3-carboxylic acid
SMILESCN(c1ccccc1)c1nc2ccccn2c1C(=O)O
InChIInChI=1S/C15H13N3O2/c1-17(11-7-3-2-4-8-11)14-13(15(19)20)18-10-6-5-9-12(18)16-14/h2-10H,1H3,(H,19,20)
InChIKeyRAPLPEBNJLIGRF-UHFFFAOYSA-N
MW267.29 g/mol
LogP2.80
Rot. Bonds3

About 2-(N-methylanilino)imidazo[1,2-a]pyridine-3-carboxylic acid

2-(N-methylanilino)imidazo[1,2-a]pyridine-3-carboxylic acid (PubChem CID 43477811) has the molecular formula C15H13N3O2 and a molecular weight of 267.29 g/mol. Its IUPAC name is 2-(N-methylanilino)imidazo[1,2-a]pyridine-3-carboxylic acid.

Molecular Properties

Compound Name2-(N-methylanilino)imidazo[1,2-a]pyridine-3-carboxylic acid
PubChem CID43477811
Molecular FormulaC15H13N3O2
Molecular Weight267.29 g/mol
Exact Mass267.10
IUPAC Name2-(N-methylanilino)imidazo[1,2-a]pyridine-3-carboxylic acid
SMILESCN(c1ccccc1)c1nc2ccccn2c1C(=O)O
InChIInChI=1S/C15H13N3O2/c1-17(11-7-3-2-4-8-11)14-13(15(19)20)18-10-6-5-9-12(18)16-14/h2-10H,1H3,(H,19,20)
InChIKeyRAPLPEBNJLIGRF-UHFFFAOYSA-N
XLogP2.80
TPSA57.84 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.29
LogP ≤ 52.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-[1-methoxypropan-2-yl(methyl)amino]imidazo[1,2-a]pyridine-3-carboxylic acid
CID 61451416
[2-(N-methylanilino)imidazo[1,2-a]pyridin-3-yl]methanol
CID 43478062
2-[ethyl(propan-2-yl)amino]imidazo[1,2-a]pyridine-3-carboxylic acid
CID 43477884
2-[3-(dimethylamino)propyl-ethylamino]imidazo[1,2-a]pyridine-3-carboxylic acid
CID 102993970
2-[2-cyanopropyl(methyl)amino]imidazo[1,2-a]pyridine-3-carboxylic acid
CID 54991956
2-[2-hydroxyethyl(propan-2-yl)amino]imidazo[1,2-a]pyridine-3-carboxylic acid
CID 54994779
2-[methyl-[(1-methylpyrazol-4-yl)methyl]amino]imidazo[1,2-a]pyridine-3-carboxylic acid
CID 61442386
2-[methyl(oxolan-2-ylmethyl)amino]imidazo[1,2-a]pyridine-3-carboxylic acid
CID 61432285
2-propan-2-ylsulfanylimidazo[1,2-a]pyridine-3-carboxylic acid
CID 61358940
2-[3-(dimethylamino)pyrrolidin-1-yl]imidazo[1,2-a]pyridine-3-carboxylic acid
CID 63163885
2-(2-hydroxyphenyl)imidazo[1,2-a]pyridine-3-carboxylic acid
CID 135044398
2-[ethyl(oxolan-2-ylmethyl)amino]imidazo[1,2-a]pyridine-3-carboxylic acid
CID 61434670

Frequently Asked Questions

What is the IUPAC name of 2-(N-methylanilino)imidazo[1,2-a]pyridine-3-carboxylic acid?
The IUPAC name of 2-(N-methylanilino)imidazo[1,2-a]pyridine-3-carboxylic acid (CID 43477811) is 2-(N-methylanilino)imidazo[1,2-a]pyridine-3-carboxylic acid.
What is the SMILES notation for 2-(N-methylanilino)imidazo[1,2-a]pyridine-3-carboxylic acid?
The canonical SMILES for 2-(N-methylanilino)imidazo[1,2-a]pyridine-3-carboxylic acid is CN(c1ccccc1)c1nc2ccccn2c1C(=O)O.
What is the InChIKey of 2-(N-methylanilino)imidazo[1,2-a]pyridine-3-carboxylic acid?
The InChIKey is RAPLPEBNJLIGRF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13N3O2/c1-17(11-7-3-2-4-8-11)14-13(15(19)20)18-10-6-5-9-12(18)16-14/h2-10H,1H3,(H,19,20).
What are the key properties of 2-(N-methylanilino)imidazo[1,2-a]pyridine-3-carboxylic acid?
2-(N-methylanilino)imidazo[1,2-a]pyridine-3-carboxylic acid has a molecular weight of 267.29 g/mol, XLogP of 2.80, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(N-methylanilino)imidazo[1,2-a]pyridine-3-carboxylic acid is sourced from PubChem (CID 43477811), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).