2-[6-(4-ethylpiperazin-1-yl)imidazo[1,2-a]pyridin-2-yl]acetic acid

C15H20N4O2 — CID 117099205

IUPAC2-[6-(4-ethylpiperazin-1-yl)imidazo[1,2-a]pyridin-2-yl]acetic acid
SMILESCCN1CCN(c2ccc3nc(CC(=O)O)cn3c2)CC1
InChIInChI=1S/C15H20N4O2/c1-2-17-5-7-18(8-6-17)13-3-4-14-16-12(9-15(20)21)10-19(14)11-13/h3-4,10-11H,2,5-9H2,1H3,(H,20,21)
InChIKeyVIUHWTHVLZTVMT-UHFFFAOYSA-N
MW288.35 g/mol
LogP1.10
Rot. Bonds4

About 2-[6-(4-ethylpiperazin-1-yl)imidazo[1,2-a]pyridin-2-yl]acetic acid

2-[6-(4-ethylpiperazin-1-yl)imidazo[1,2-a]pyridin-2-yl]acetic acid (PubChem CID 117099205) has the molecular formula C15H20N4O2 and a molecular weight of 288.35 g/mol. Its IUPAC name is 2-[6-(4-ethylpiperazin-1-yl)imidazo[1,2-a]pyridin-2-yl]acetic acid.

Molecular Properties

Compound Name2-[6-(4-ethylpiperazin-1-yl)imidazo[1,2-a]pyridin-2-yl]acetic acid
PubChem CID117099205
Molecular FormulaC15H20N4O2
Molecular Weight288.35 g/mol
Exact Mass288.16
IUPAC Name2-[6-(4-ethylpiperazin-1-yl)imidazo[1,2-a]pyridin-2-yl]acetic acid
SMILESCCN1CCN(c2ccc3nc(CC(=O)O)cn3c2)CC1
InChIInChI=1S/C15H20N4O2/c1-2-17-5-7-18(8-6-17)13-3-4-14-16-12(9-15(20)21)10-19(14)11-13/h3-4,10-11H,2,5-9H2,1H3,(H,20,21)
InChIKeyVIUHWTHVLZTVMT-UHFFFAOYSA-N
XLogP1.10
TPSA61.08 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.35
LogP ≤ 51.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-[6-(2,6-dimethylpiperidin-1-yl)imidazo[1,2-a]pyridin-2-yl]acetic acid
CID 82022022
N-methyl-2-(6-piperazin-1-ylimidazo[1,2-a]pyridin-2-yl)acetamide
CID 82055266
2-[6-(dimethylamino)imidazo[1,2-a]pyridin-2-yl]acetic acid
CID 82022029
2-[4-(2-ethylimidazo[1,2-a]pyridin-6-yl)piperazin-1-yl]sulfinylacetamide
CID 155469585
2-ethyl-6-[4-(1H-imidazol-5-ylmethyl)piperazin-1-yl]imidazo[1,2-a]pyridine
CID 141415821
2-[4-[(6-methylimidazo[1,2-a]pyridin-2-yl)methyl]piperazin-1-yl]acetic acid
CID 43521725
6-(4-methylpiperidin-1-yl)imidazo[1,2-a]pyridine-2-carboxylic acid
CID 117099177
2-[4-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]piperazin-1-yl]acetic acid
CID 43521849
2-[5-(4-ethylpiperazin-1-yl)benzimidazol-1-yl]acetic acid
CID 83972284
ethane;1-ethyl-4-(4-methylphenyl)-1,4-diazepane
CID 177351014
N-[4-(4-ethylpiperazin-1-yl)phenyl]-2-phenylacetamide
CID 969221
1-(6-fluoroimidazo[1,2-a]pyridin-2-yl)propan-2-one
CID 135396946

Frequently Asked Questions

What is the IUPAC name of 2-[6-(4-ethylpiperazin-1-yl)imidazo[1,2-a]pyridin-2-yl]acetic acid?
The IUPAC name of 2-[6-(4-ethylpiperazin-1-yl)imidazo[1,2-a]pyridin-2-yl]acetic acid (CID 117099205) is 2-[6-(4-ethylpiperazin-1-yl)imidazo[1,2-a]pyridin-2-yl]acetic acid.
What is the SMILES notation for 2-[6-(4-ethylpiperazin-1-yl)imidazo[1,2-a]pyridin-2-yl]acetic acid?
The canonical SMILES for 2-[6-(4-ethylpiperazin-1-yl)imidazo[1,2-a]pyridin-2-yl]acetic acid is CCN1CCN(c2ccc3nc(CC(=O)O)cn3c2)CC1.
What is the InChIKey of 2-[6-(4-ethylpiperazin-1-yl)imidazo[1,2-a]pyridin-2-yl]acetic acid?
The InChIKey is VIUHWTHVLZTVMT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N4O2/c1-2-17-5-7-18(8-6-17)13-3-4-14-16-12(9-15(20)21)10-19(14)11-13/h3-4,10-11H,2,5-9H2,1H3,(H,20,21).
What are the key properties of 2-[6-(4-ethylpiperazin-1-yl)imidazo[1,2-a]pyridin-2-yl]acetic acid?
2-[6-(4-ethylpiperazin-1-yl)imidazo[1,2-a]pyridin-2-yl]acetic acid has a molecular weight of 288.35 g/mol, XLogP of 1.10, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[6-(4-ethylpiperazin-1-yl)imidazo[1,2-a]pyridin-2-yl]acetic acid is sourced from PubChem (CID 117099205), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).