ethyl 2-[[6,8-dichloro-2-(4-chlorophenyl)imidazo[1,2-a]pyridin-3-yl]amino]acetate

C17H14Cl3N3O2 — CID 83282409

IUPACethyl 2-[[6,8-dichloro-2-(4-chlorophenyl)imidazo[1,2-a]pyridin-3-yl]amino]acetate
SMILESCCOC(=O)CNc1c(-c2ccc(Cl)cc2)nc2c(Cl)cc(Cl)cn12
InChIInChI=1S/C17H14Cl3N3O2/c1-2-25-14(24)8-21-17-15(10-3-5-11(18)6-4-10)22-16-13(20)7-12(19)9-23(16)17/h3-7,9,21H,2,8H2,1H3
InChIKeyXCCJPFKLRPRRQO-UHFFFAOYSA-N
MW398.68 g/mol
LogP4.94
Rot. Bonds5

About ethyl 2-[[6,8-dichloro-2-(4-chlorophenyl)imidazo[1,2-a]pyridin-3-yl]amino]acetate

ethyl 2-[[6,8-dichloro-2-(4-chlorophenyl)imidazo[1,2-a]pyridin-3-yl]amino]acetate (PubChem CID 83282409) has the molecular formula C17H14Cl3N3O2 and a molecular weight of 398.68 g/mol. Its IUPAC name is ethyl 2-[[6,8-dichloro-2-(4-chlorophenyl)imidazo[1,2-a]pyridin-3-yl]amino]acetate.

Molecular Properties

Compound Nameethyl 2-[[6,8-dichloro-2-(4-chlorophenyl)imidazo[1,2-a]pyridin-3-yl]amino]acetate
PubChem CID83282409
Molecular FormulaC17H14Cl3N3O2
Molecular Weight398.68 g/mol
Exact Mass397.02
IUPAC Nameethyl 2-[[6,8-dichloro-2-(4-chlorophenyl)imidazo[1,2-a]pyridin-3-yl]amino]acetate
SMILESCCOC(=O)CNc1c(-c2ccc(Cl)cc2)nc2c(Cl)cc(Cl)cn12
InChIInChI=1S/C17H14Cl3N3O2/c1-2-25-14(24)8-21-17-15(10-3-5-11(18)6-4-10)22-16-13(20)7-12(19)9-23(16)17/h3-7,9,21H,2,8H2,1H3
InChIKeyXCCJPFKLRPRRQO-UHFFFAOYSA-N
XLogP4.94
TPSA55.63 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500398.68
LogP ≤ 54.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze ethyl 2-[[6,8-dichloro-2-(4-chlorophenyl)imidazo[1,2-a]pyridin-3-yl]amino]acetate with MolForge

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Related Compounds

6-Chloro-2-(4-chlorophenyl)imidazo(1,2-a)pyridine
CID 717647
N-Butyl-2-[6,8-dichloro-2-(4-chloro-phenyl)-imidazo[1,2-a]pyridin-3-yl]-acetamide
CID 11441263
6-Chloro-2-(4-chlorophenyl)-3-(morpholinomethyl)imidazo[1,2-a]pyridine
CID 3802200
Ethyl 2-(6-chloro-2-(4-chlorophenyl)imidazo[1,2-a]pyridin-3-yl)acetate
CID 10783975
(2-(4-Chlorophenyl)imidazo[1,2-a]pyridin-3-yl)methanamine
CID 2757796
(6-Chloro-2-phenyl-imidazo[1,2-a]pyridin-3-ylamino)-acetic acid ethyl ester
CID 860305
ethyl N-[2-(4-chlorophenyl)imidazo[1,2-a]pyrazin-3-yl]glycinate
CID 3243402
3N-551S
CID 3839615
6-Chloro-3-(morpholinomethyl)-2-phenylimidazo[1,2-a]pyridine
CID 4637244
Methyl 2-[(6-bromo-2-phenylimidazo[1,2-a]pyridin-3-yl)amino]acetate
CID 5322800
N-benzyl-2-(4-chlorophenyl)-6-methylimidazo[1,2-a]pyridin-3-amine
CID 42738384
6-chloro-N-cyclohexyl-2-(4-morpholin-4-ylphenyl)imidazo[1,2-a]pyridin-3-amine
CID 57393138

Frequently Asked Questions

What is the IUPAC name of ethyl 2-[[6,8-dichloro-2-(4-chlorophenyl)imidazo[1,2-a]pyridin-3-yl]amino]acetate?
The IUPAC name of ethyl 2-[[6,8-dichloro-2-(4-chlorophenyl)imidazo[1,2-a]pyridin-3-yl]amino]acetate (CID 83282409) is ethyl 2-[[6,8-dichloro-2-(4-chlorophenyl)imidazo[1,2-a]pyridin-3-yl]amino]acetate.
What is the SMILES notation for ethyl 2-[[6,8-dichloro-2-(4-chlorophenyl)imidazo[1,2-a]pyridin-3-yl]amino]acetate?
The canonical SMILES for ethyl 2-[[6,8-dichloro-2-(4-chlorophenyl)imidazo[1,2-a]pyridin-3-yl]amino]acetate is CCOC(=O)CNc1c(-c2ccc(Cl)cc2)nc2c(Cl)cc(Cl)cn12.
What is the InChIKey of ethyl 2-[[6,8-dichloro-2-(4-chlorophenyl)imidazo[1,2-a]pyridin-3-yl]amino]acetate?
The InChIKey is XCCJPFKLRPRRQO-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H14Cl3N3O2/c1-2-25-14(24)8-21-17-15(10-3-5-11(18)6-4-10)22-16-13(20)7-12(19)9-23(16)17/h3-7,9,21H,2,8H2,1H3.
What are the key properties of ethyl 2-[[6,8-dichloro-2-(4-chlorophenyl)imidazo[1,2-a]pyridin-3-yl]amino]acetate?
ethyl 2-[[6,8-dichloro-2-(4-chlorophenyl)imidazo[1,2-a]pyridin-3-yl]amino]acetate has a molecular weight of 398.68 g/mol, XLogP of 4.94, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl 2-[[6,8-dichloro-2-(4-chlorophenyl)imidazo[1,2-a]pyridin-3-yl]amino]acetate is sourced from PubChem (CID 83282409), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).