2-(2-carbamoylpyrrolidin-1-yl)imidazo[1,2-a]pyridine-3-carboxylic acid

C13H14N4O3 — CID 43477869

IUPAC2-(2-carbamoylpyrrolidin-1-yl)imidazo[1,2-a]pyridine-3-carboxylic acid
SMILESNC(=O)C1CCCN1c1nc2ccccn2c1C(=O)O
InChIInChI=1S/C13H14N4O3/c14-11(18)8-4-3-7-16(8)12-10(13(19)20)17-6-2-1-5-9(17)15-12/h1-2,5-6,8H,3-4,7H2,(H2,14,18)(H,19,20)
InChIKeyJXMQGICMOYHLMX-UHFFFAOYSA-N
MW274.28 g/mol
LogP0.49
Rot. Bonds3

About 2-(2-carbamoylpyrrolidin-1-yl)imidazo[1,2-a]pyridine-3-carboxylic acid

2-(2-carbamoylpyrrolidin-1-yl)imidazo[1,2-a]pyridine-3-carboxylic acid (PubChem CID 43477869) has the molecular formula C13H14N4O3 and a molecular weight of 274.28 g/mol. Its IUPAC name is 2-(2-carbamoylpyrrolidin-1-yl)imidazo[1,2-a]pyridine-3-carboxylic acid.

Molecular Properties

Compound Name2-(2-carbamoylpyrrolidin-1-yl)imidazo[1,2-a]pyridine-3-carboxylic acid
PubChem CID43477869
Molecular FormulaC13H14N4O3
Molecular Weight274.28 g/mol
Exact Mass274.11
IUPAC Name2-(2-carbamoylpyrrolidin-1-yl)imidazo[1,2-a]pyridine-3-carboxylic acid
SMILESNC(=O)C1CCCN1c1nc2ccccn2c1C(=O)O
InChIInChI=1S/C13H14N4O3/c14-11(18)8-4-3-7-16(8)12-10(13(19)20)17-6-2-1-5-9(17)15-12/h1-2,5-6,8H,3-4,7H2,(H2,14,18)(H,19,20)
InChIKeyJXMQGICMOYHLMX-UHFFFAOYSA-N
XLogP0.49
TPSA100.93 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.28
LogP ≤ 50.49
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-(2-ethylpiperidin-1-yl)imidazo[1,2-a]pyridine-3-carboxylic acid
CID 43477885
2-[2-(hydroxymethyl)azepan-1-yl]imidazo[1,2-a]pyridine-3-carboxylic acid
CID 116635079
2-(2-ethylazepan-1-yl)imidazo[1,2-a]pyridine-3-carboxylic acid
CID 104690132
2-(4-methylpiperidin-1-yl)imidazo[1,2-a]pyridine-3-carboxylic acid
CID 43477803
1-(2-aminoquinazolin-4-yl)pyrrolidine-2-carboxamide
CID 80765389
2-(3-ethylpiperidin-1-yl)imidazo[1,2-a]pyridine-3-carboxylic acid
CID 43584666
2-[3-(aminomethyl)pyrrolidin-1-yl]imidazo[1,2-a]pyridine-3-carboxylic acid
CID 62063458
2-(3-methyl-1,1-dioxo-1,4-thiazinan-4-yl)imidazo[1,2-a]pyridine-3-carboxylic acid
CID 102883872
2-(3-hydroxy-4-methylpiperidin-1-yl)imidazo[1,2-a]pyridine-3-carboxylic acid
CID 102958616
(2S)-1-(2-chloropyrrolo[2,1-f][1,2,4]triazin-4-yl)pyrrolidine-2-carboxamide
CID 142498380
(2S)-1-(2-phenylquinazolin-4-yl)pyrrolidine-2-carboxamide
CID 40810173
2-[3-(dimethylamino)pyrrolidin-1-yl]imidazo[1,2-a]pyridine-3-carboxylic acid
CID 63163885

Frequently Asked Questions

What is the IUPAC name of 2-(2-carbamoylpyrrolidin-1-yl)imidazo[1,2-a]pyridine-3-carboxylic acid?
The IUPAC name of 2-(2-carbamoylpyrrolidin-1-yl)imidazo[1,2-a]pyridine-3-carboxylic acid (CID 43477869) is 2-(2-carbamoylpyrrolidin-1-yl)imidazo[1,2-a]pyridine-3-carboxylic acid.
What is the SMILES notation for 2-(2-carbamoylpyrrolidin-1-yl)imidazo[1,2-a]pyridine-3-carboxylic acid?
The canonical SMILES for 2-(2-carbamoylpyrrolidin-1-yl)imidazo[1,2-a]pyridine-3-carboxylic acid is NC(=O)C1CCCN1c1nc2ccccn2c1C(=O)O.
What is the InChIKey of 2-(2-carbamoylpyrrolidin-1-yl)imidazo[1,2-a]pyridine-3-carboxylic acid?
The InChIKey is JXMQGICMOYHLMX-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14N4O3/c14-11(18)8-4-3-7-16(8)12-10(13(19)20)17-6-2-1-5-9(17)15-12/h1-2,5-6,8H,3-4,7H2,(H2,14,18)(H,19,20).
What are the key properties of 2-(2-carbamoylpyrrolidin-1-yl)imidazo[1,2-a]pyridine-3-carboxylic acid?
2-(2-carbamoylpyrrolidin-1-yl)imidazo[1,2-a]pyridine-3-carboxylic acid has a molecular weight of 274.28 g/mol, XLogP of 0.49, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-carbamoylpyrrolidin-1-yl)imidazo[1,2-a]pyridine-3-carboxylic acid is sourced from PubChem (CID 43477869), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).