2-(1-pyrrolidin-1-ylpropan-2-ylamino)imidazo[1,2-a]pyridine-3-carboxylic acid

C15H20N4O2 — CID 61477551

IUPAC2-(1-pyrrolidin-1-ylpropan-2-ylamino)imidazo[1,2-a]pyridine-3-carboxylic acid
SMILESCC(CN1CCCC1)Nc1nc2ccccn2c1C(=O)O
InChIInChI=1S/C15H20N4O2/c1-11(10-18-7-4-5-8-18)16-14-13(15(20)21)19-9-3-2-6-12(19)17-14/h2-3,6,9,11,16H,4-5,7-8,10H2,1H3,(H,20,21)
InChIKeyNSWRSJABHCKKPS-UHFFFAOYSA-N
MW288.35 g/mol
LogP1.93
Rot. Bonds5

About 2-(1-pyrrolidin-1-ylpropan-2-ylamino)imidazo[1,2-a]pyridine-3-carboxylic acid

2-(1-pyrrolidin-1-ylpropan-2-ylamino)imidazo[1,2-a]pyridine-3-carboxylic acid (PubChem CID 61477551) has the molecular formula C15H20N4O2 and a molecular weight of 288.35 g/mol. Its IUPAC name is 2-(1-pyrrolidin-1-ylpropan-2-ylamino)imidazo[1,2-a]pyridine-3-carboxylic acid.

Molecular Properties

Compound Name2-(1-pyrrolidin-1-ylpropan-2-ylamino)imidazo[1,2-a]pyridine-3-carboxylic acid
PubChem CID61477551
Molecular FormulaC15H20N4O2
Molecular Weight288.35 g/mol
Exact Mass288.16
IUPAC Name2-(1-pyrrolidin-1-ylpropan-2-ylamino)imidazo[1,2-a]pyridine-3-carboxylic acid
SMILESCC(CN1CCCC1)Nc1nc2ccccn2c1C(=O)O
InChIInChI=1S/C15H20N4O2/c1-11(10-18-7-4-5-8-18)16-14-13(15(20)21)19-9-3-2-6-12(19)17-14/h2-3,6,9,11,16H,4-5,7-8,10H2,1H3,(H,20,21)
InChIKeyNSWRSJABHCKKPS-UHFFFAOYSA-N
XLogP1.93
TPSA69.87 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.35
LogP ≤ 51.93
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-(1-pyrrolidin-1-ylpropan-2-ylamino)imidazo[1,2-a]pyridine-3-carboxylic acid?
The IUPAC name of 2-(1-pyrrolidin-1-ylpropan-2-ylamino)imidazo[1,2-a]pyridine-3-carboxylic acid (CID 61477551) is 2-(1-pyrrolidin-1-ylpropan-2-ylamino)imidazo[1,2-a]pyridine-3-carboxylic acid.
What is the SMILES notation for 2-(1-pyrrolidin-1-ylpropan-2-ylamino)imidazo[1,2-a]pyridine-3-carboxylic acid?
The canonical SMILES for 2-(1-pyrrolidin-1-ylpropan-2-ylamino)imidazo[1,2-a]pyridine-3-carboxylic acid is CC(CN1CCCC1)Nc1nc2ccccn2c1C(=O)O.
What is the InChIKey of 2-(1-pyrrolidin-1-ylpropan-2-ylamino)imidazo[1,2-a]pyridine-3-carboxylic acid?
The InChIKey is NSWRSJABHCKKPS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N4O2/c1-11(10-18-7-4-5-8-18)16-14-13(15(20)21)19-9-3-2-6-12(19)17-14/h2-3,6,9,11,16H,4-5,7-8,10H2,1H3,(H,20,21).
What are the key properties of 2-(1-pyrrolidin-1-ylpropan-2-ylamino)imidazo[1,2-a]pyridine-3-carboxylic acid?
2-(1-pyrrolidin-1-ylpropan-2-ylamino)imidazo[1,2-a]pyridine-3-carboxylic acid has a molecular weight of 288.35 g/mol, XLogP of 1.93, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-pyrrolidin-1-ylpropan-2-ylamino)imidazo[1,2-a]pyridine-3-carboxylic acid is sourced from PubChem (CID 61477551), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).