2-[3-[(4-ethylpiperazin-1-yl)methyl]-5-methylimidazo[1,2-a]pyridin-2-yl]acetic acid

C17H24N4O2 — CID 92858132

IUPAC2-[3-[(4-ethylpiperazin-1-yl)methyl]-5-methylimidazo[1,2-a]pyridin-2-yl]acetic acid
SMILESCCN1CCN(Cc2c(CC(=O)O)nc3cccc(C)n23)CC1
InChIInChI=1S/C17H24N4O2/c1-3-19-7-9-20(10-8-19)12-15-14(11-17(22)23)18-16-6-4-5-13(2)21(15)16/h4-6H,3,7-12H2,1-2H3,(H,22,23)
InChIKeyDAPQFLNLRZUQSK-UHFFFAOYSA-N
MW316.40 g/mol
LogP1.41
Rot. Bonds5

About 2-[3-[(4-ethylpiperazin-1-yl)methyl]-5-methylimidazo[1,2-a]pyridin-2-yl]acetic acid

2-[3-[(4-ethylpiperazin-1-yl)methyl]-5-methylimidazo[1,2-a]pyridin-2-yl]acetic acid (PubChem CID 92858132) has the molecular formula C17H24N4O2 and a molecular weight of 316.40 g/mol. Its IUPAC name is 2-[3-[(4-ethylpiperazin-1-yl)methyl]-5-methylimidazo[1,2-a]pyridin-2-yl]acetic acid.

Molecular Properties

Compound Name2-[3-[(4-ethylpiperazin-1-yl)methyl]-5-methylimidazo[1,2-a]pyridin-2-yl]acetic acid
PubChem CID92858132
Molecular FormulaC17H24N4O2
Molecular Weight316.40 g/mol
Exact Mass316.19
IUPAC Name2-[3-[(4-ethylpiperazin-1-yl)methyl]-5-methylimidazo[1,2-a]pyridin-2-yl]acetic acid
SMILESCCN1CCN(Cc2c(CC(=O)O)nc3cccc(C)n23)CC1
InChIInChI=1S/C17H24N4O2/c1-3-19-7-9-20(10-8-19)12-15-14(11-17(22)23)18-16-6-4-5-13(2)21(15)16/h4-6H,3,7-12H2,1-2H3,(H,22,23)
InChIKeyDAPQFLNLRZUQSK-UHFFFAOYSA-N
XLogP1.41
TPSA61.08 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.40
LogP ≤ 51.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 2-[3-[(4-ethylpiperazin-1-yl)methyl]-5-methylimidazo[1,2-a]pyridin-2-yl]acetic acid with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-benzyl-5-methyl-3-(piperazin-1-ylmethyl)imidazo[1,2-a]pyridine
CID 94963786
2-[3-[(4-methylpiperazin-1-yl)methyl]imidazo[1,2-a]pyridin-2-yl]acetic acid
CID 82028866
2-[3-(morpholin-4-ylmethyl)imidazo[1,2-a]pyridin-2-yl]acetic acid
CID 82028868
2-[6-methyl-3-(pyrrolidin-1-ylmethyl)imidazo[1,2-a]pyridin-2-yl]acetic acid
CID 39119804
3-[(dipropylamino)methyl]-5-methylimidazo[1,2-a]pyridine-2-carboxylic acid
CID 39121673
2-[3-(azepan-1-ylmethyl)-6-methylimidazo[1,2-a]pyridin-2-yl]acetic acid
CID 39119717
2-[7-methyl-3-[(4-methylpiperidin-1-yl)methyl]imidazo[1,2-a]pyridin-2-yl]acetic acid
CID 82028883
3-[5-methyl-3-[(4-methylpiperazin-1-yl)methyl]imidazo[1,2-a]pyridin-2-yl]aniline
CID 39120486
3-(1-ethylpiperidin-4-yl)-5-methylimidazo[1,5-a]pyridine-1-carboxylic acid
CID 117250436
[2-[(4-ethylphenyl)methyl]-5-methylimidazo[1,2-a]pyridin-3-yl]methanamine
CID 82223384
1-[6-[(4-ethylpiperazin-1-yl)methyl]-2-pyridinyl]-2-methylpropan-1-one
CID 163369559
2-[6-(4-ethylpiperazin-1-yl)imidazo[1,2-a]pyridin-2-yl]acetic acid
CID 117099205

Frequently Asked Questions

What is the IUPAC name of 2-[3-[(4-ethylpiperazin-1-yl)methyl]-5-methylimidazo[1,2-a]pyridin-2-yl]acetic acid?
The IUPAC name of 2-[3-[(4-ethylpiperazin-1-yl)methyl]-5-methylimidazo[1,2-a]pyridin-2-yl]acetic acid (CID 92858132) is 2-[3-[(4-ethylpiperazin-1-yl)methyl]-5-methylimidazo[1,2-a]pyridin-2-yl]acetic acid.
What is the SMILES notation for 2-[3-[(4-ethylpiperazin-1-yl)methyl]-5-methylimidazo[1,2-a]pyridin-2-yl]acetic acid?
The canonical SMILES for 2-[3-[(4-ethylpiperazin-1-yl)methyl]-5-methylimidazo[1,2-a]pyridin-2-yl]acetic acid is CCN1CCN(Cc2c(CC(=O)O)nc3cccc(C)n23)CC1.
What is the InChIKey of 2-[3-[(4-ethylpiperazin-1-yl)methyl]-5-methylimidazo[1,2-a]pyridin-2-yl]acetic acid?
The InChIKey is DAPQFLNLRZUQSK-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24N4O2/c1-3-19-7-9-20(10-8-19)12-15-14(11-17(22)23)18-16-6-4-5-13(2)21(15)16/h4-6H,3,7-12H2,1-2H3,(H,22,23).
What are the key properties of 2-[3-[(4-ethylpiperazin-1-yl)methyl]-5-methylimidazo[1,2-a]pyridin-2-yl]acetic acid?
2-[3-[(4-ethylpiperazin-1-yl)methyl]-5-methylimidazo[1,2-a]pyridin-2-yl]acetic acid has a molecular weight of 316.40 g/mol, XLogP of 1.41, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-[(4-ethylpiperazin-1-yl)methyl]-5-methylimidazo[1,2-a]pyridin-2-yl]acetic acid is sourced from PubChem (CID 92858132), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).