methyl 2-(4-chlorophenyl)imidazo[1,2-a]pyridine-8-carboxylate

C15H11ClN2O2 — CID 117137725

IUPACmethyl 2-(4-chlorophenyl)imidazo[1,2-a]pyridine-8-carboxylate
SMILESCOC(=O)c1cccn2cc(-c3ccc(Cl)cc3)nc12
InChIInChI=1S/C15H11ClN2O2/c1-20-15(19)12-3-2-8-18-9-13(17-14(12)18)10-4-6-11(16)7-5-10/h2-9H,1H3
InChIKeyZFNDDDQOPCDHNF-UHFFFAOYSA-N
MW286.72 g/mol
LogP3.44
Rot. Bonds2

About methyl 2-(4-chlorophenyl)imidazo[1,2-a]pyridine-8-carboxylate

methyl 2-(4-chlorophenyl)imidazo[1,2-a]pyridine-8-carboxylate (PubChem CID 117137725) has the molecular formula C15H11ClN2O2 and a molecular weight of 286.72 g/mol. Its IUPAC name is methyl 2-(4-chlorophenyl)imidazo[1,2-a]pyridine-8-carboxylate.

Molecular Properties

Compound Namemethyl 2-(4-chlorophenyl)imidazo[1,2-a]pyridine-8-carboxylate
PubChem CID117137725
Molecular FormulaC15H11ClN2O2
Molecular Weight286.72 g/mol
Exact Mass286.05
IUPAC Namemethyl 2-(4-chlorophenyl)imidazo[1,2-a]pyridine-8-carboxylate
SMILESCOC(=O)c1cccn2cc(-c3ccc(Cl)cc3)nc12
InChIInChI=1S/C15H11ClN2O2/c1-20-15(19)12-3-2-8-18-9-13(17-14(12)18)10-4-6-11(16)7-5-10/h2-9H,1H3
InChIKeyZFNDDDQOPCDHNF-UHFFFAOYSA-N
XLogP3.44
TPSA43.60 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.72
LogP ≤ 53.44
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

methyl 2-thiophen-2-ylimidazo[1,2-a]pyridine-8-carboxylate
CID 117137140
[2-(4-chlorophenyl)imidazo[1,2-a]pyridin-8-yl] benzoate
CID 171984006
ethyl 2-phenylimidazo[1,2-a]pyridine-8-carboxylate;hydrobromide
CID 67768891
ethyl 2-(4-formylphenyl)imidazo[1,2-a]pyridine-8-carboxylate
CID 58208423
ethyl 2-[4-(difluoromethyl)phenyl]imidazo[1,2-a]pyridine-8-carboxylate
CID 58208449
2-(4-chlorophenyl)-N-[4-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]acetamide
CID 121028746
5-chloro-2-methoxy-N-[2-methoxy-5-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]benzamide
CID 122323354
methyl 2-[(2-chlorophenoxy)methyl]imidazo[1,2-a]pyridine-8-carboxylate
CID 117256742
methyl 2-piperidin-4-ylimidazo[1,2-a]pyridine-8-carboxylate
CID 117136001
2-[4-(trifluoromethyl)phenyl]imidazo[1,2-a]pyridine-8-carboxylic acid
CID 117137722
methyl 2-[(2-methoxyphenyl)methyl]imidazo[1,2-a]pyridine-8-carboxylate
CID 117137405
methyl 2-(thiolan-3-yl)imidazo[1,2-a]pyridine-8-carboxylate
CID 117135873

Frequently Asked Questions

What is the IUPAC name of methyl 2-(4-chlorophenyl)imidazo[1,2-a]pyridine-8-carboxylate?
The IUPAC name of methyl 2-(4-chlorophenyl)imidazo[1,2-a]pyridine-8-carboxylate (CID 117137725) is methyl 2-(4-chlorophenyl)imidazo[1,2-a]pyridine-8-carboxylate.
What is the SMILES notation for methyl 2-(4-chlorophenyl)imidazo[1,2-a]pyridine-8-carboxylate?
The canonical SMILES for methyl 2-(4-chlorophenyl)imidazo[1,2-a]pyridine-8-carboxylate is COC(=O)c1cccn2cc(-c3ccc(Cl)cc3)nc12.
What is the InChIKey of methyl 2-(4-chlorophenyl)imidazo[1,2-a]pyridine-8-carboxylate?
The InChIKey is ZFNDDDQOPCDHNF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11ClN2O2/c1-20-15(19)12-3-2-8-18-9-13(17-14(12)18)10-4-6-11(16)7-5-10/h2-9H,1H3.
What are the key properties of methyl 2-(4-chlorophenyl)imidazo[1,2-a]pyridine-8-carboxylate?
methyl 2-(4-chlorophenyl)imidazo[1,2-a]pyridine-8-carboxylate has a molecular weight of 286.72 g/mol, XLogP of 3.44, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 2-(4-chlorophenyl)imidazo[1,2-a]pyridine-8-carboxylate is sourced from PubChem (CID 117137725), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).