ethyl 2-(6-amino-2-phenylimidazo[1,2-a]pyridin-3-yl)acetate

C17H17N3O2 — CID 10541904

IUPACethyl 2-(6-amino-2-phenylimidazo[1,2-a]pyridin-3-yl)acetate
SMILESCCOC(=O)Cc1c(-c2ccccc2)nc2ccc(N)cn12
InChIInChI=1S/C17H17N3O2/c1-2-22-16(21)10-14-17(12-6-4-3-5-7-12)19-15-9-8-13(18)11-20(14)15/h3-9,11H,2,10,18H2,1H3
InChIKeyAYRIUPHWCGBAAE-UHFFFAOYSA-N
MW295.34 g/mol
LogP2.69
Rot. Bonds4

About ethyl 2-(6-amino-2-phenylimidazo[1,2-a]pyridin-3-yl)acetate

ethyl 2-(6-amino-2-phenylimidazo[1,2-a]pyridin-3-yl)acetate (PubChem CID 10541904) has the molecular formula C17H17N3O2 and a molecular weight of 295.34 g/mol. Its IUPAC name is ethyl 2-(6-amino-2-phenylimidazo[1,2-a]pyridin-3-yl)acetate.

Molecular Properties

Compound Nameethyl 2-(6-amino-2-phenylimidazo[1,2-a]pyridin-3-yl)acetate
PubChem CID10541904
Molecular FormulaC17H17N3O2
Molecular Weight295.34 g/mol
Exact Mass295.13
IUPAC Nameethyl 2-(6-amino-2-phenylimidazo[1,2-a]pyridin-3-yl)acetate
SMILESCCOC(=O)Cc1c(-c2ccccc2)nc2ccc(N)cn12
InChIInChI=1S/C17H17N3O2/c1-2-22-16(21)10-14-17(12-6-4-3-5-7-12)19-15-9-8-13(18)11-20(14)15/h3-9,11H,2,10,18H2,1H3
InChIKeyAYRIUPHWCGBAAE-UHFFFAOYSA-N
XLogP2.69
TPSA69.62 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.34
LogP ≤ 52.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

ethyl 2-(6-bromo-2-phenylimidazo[1,2-a]pyridin-3-yl)acetate
CID 11792775
ethyl 2-[2-(4-methoxyphenyl)-6-methylimidazo[1,2-a]pyridin-3-yl]acetate
CID 58763578
ethyl 2-(6-chloro-8-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)acetate
CID 165351332
3-[[benzyl(methyl)amino]methyl]-2-phenylimidazo[1,2-a]pyridin-6-amine
CID 39130256
ethyl 2-(6-chloro-7-methyl-2-phenylimidazo[1,2-b]pyridazin-3-yl)acetate
CID 10735152
ethyl 2-[6-amino-3-[[2-hydroxyethyl(methyl)amino]methyl]imidazo[1,2-a]pyridin-2-yl]acetate
CID 93206086
ethyl 2-[(6-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)amino]acetate
CID 808619
N,N-dimethyl-2-[6-methyl-2-(4-methylphenyl)imidazo[1,2-a]pyridin-3-yl]acetamide;oxalic acid
CID 175437042
6-amino-3-ethylimidazo[1,2-a]pyridine-2-carboxylic acid
CID 118879739
ethane;2-[6-methyl-2-(4-methylphenyl)imidazo[1,2-a]pyridin-3-yl]acetic acid
CID 143742261
2-[6-methyl-2-(4-methylphenyl)imidazo[1,2-a]pyridin-3-yl]acetic acid;hydrochloride
CID 74889750
2-[[6-amino-2-(4-methylphenyl)imidazo[1,2-a]pyridin-3-yl]methyl-methylamino]ethanol
CID 93206085

Frequently Asked Questions

What is the IUPAC name of ethyl 2-(6-amino-2-phenylimidazo[1,2-a]pyridin-3-yl)acetate?
The IUPAC name of ethyl 2-(6-amino-2-phenylimidazo[1,2-a]pyridin-3-yl)acetate (CID 10541904) is ethyl 2-(6-amino-2-phenylimidazo[1,2-a]pyridin-3-yl)acetate.
What is the SMILES notation for ethyl 2-(6-amino-2-phenylimidazo[1,2-a]pyridin-3-yl)acetate?
The canonical SMILES for ethyl 2-(6-amino-2-phenylimidazo[1,2-a]pyridin-3-yl)acetate is CCOC(=O)Cc1c(-c2ccccc2)nc2ccc(N)cn12.
What is the InChIKey of ethyl 2-(6-amino-2-phenylimidazo[1,2-a]pyridin-3-yl)acetate?
The InChIKey is AYRIUPHWCGBAAE-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17N3O2/c1-2-22-16(21)10-14-17(12-6-4-3-5-7-12)19-15-9-8-13(18)11-20(14)15/h3-9,11H,2,10,18H2,1H3.
What are the key properties of ethyl 2-(6-amino-2-phenylimidazo[1,2-a]pyridin-3-yl)acetate?
ethyl 2-(6-amino-2-phenylimidazo[1,2-a]pyridin-3-yl)acetate has a molecular weight of 295.34 g/mol, XLogP of 2.69, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl 2-(6-amino-2-phenylimidazo[1,2-a]pyridin-3-yl)acetate is sourced from PubChem (CID 10541904), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).