imidazo[1,2-a]pyridin-2-ylmethyl 2-(5-methyl-1,3,4-oxadiazol-2-yl)benzoate

C18H14N4O3 — CID 75500455

IUPACimidazo[1,2-a]pyridin-2-ylmethyl 2-(5-methyl-1,3,4-oxadiazol-2-yl)benzoate
SMILESCc1nnc(-c2ccccc2C(=O)OCc2cn3ccccc3n2)o1
InChIInChI=1S/C18H14N4O3/c1-12-20-21-17(25-12)14-6-2-3-7-15(14)18(23)24-11-13-10-22-9-5-4-8-16(22)19-13/h2-10H,11H2,1H3
InChIKeyQWZQSWFYENSQKS-UHFFFAOYSA-N
MW334.34 g/mol
LogP3.05
Rot. Bonds4

About imidazo[1,2-a]pyridin-2-ylmethyl 2-(5-methyl-1,3,4-oxadiazol-2-yl)benzoate

imidazo[1,2-a]pyridin-2-ylmethyl 2-(5-methyl-1,3,4-oxadiazol-2-yl)benzoate (PubChem CID 75500455) has the molecular formula C18H14N4O3 and a molecular weight of 334.34 g/mol. Its IUPAC name is imidazo[1,2-a]pyridin-2-ylmethyl 2-(5-methyl-1,3,4-oxadiazol-2-yl)benzoate.

Molecular Properties

Compound Nameimidazo[1,2-a]pyridin-2-ylmethyl 2-(5-methyl-1,3,4-oxadiazol-2-yl)benzoate
PubChem CID75500455
Molecular FormulaC18H14N4O3
Molecular Weight334.34 g/mol
Exact Mass334.11
IUPAC Nameimidazo[1,2-a]pyridin-2-ylmethyl 2-(5-methyl-1,3,4-oxadiazol-2-yl)benzoate
SMILESCc1nnc(-c2ccccc2C(=O)OCc2cn3ccccc3n2)o1
InChIInChI=1S/C18H14N4O3/c1-12-20-21-17(25-12)14-6-2-3-7-15(14)18(23)24-11-13-10-22-9-5-4-8-16(22)19-13/h2-10H,11H2,1H3
InChIKeyQWZQSWFYENSQKS-UHFFFAOYSA-N
XLogP3.05
TPSA82.52 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500334.34
LogP ≤ 53.05
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

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Related Compounds

imidazo[1,2-a]pyridin-2-ylmethyl 1-amino-9,10-dioxoanthracene-2-carboxylate
CID 55372410
3-(imidazo[1,2-a]pyridin-2-ylmethoxy)-2-methylbenzoic acid
CID 82810212
imidazo[1,2-a]pyridin-2-ylmethyl 4-aminobenzoate
CID 60655585
(4-fluoro-3-methoxyphenyl)methyl 2-(5-methyl-1,3,4-oxadiazol-2-yl)benzoate
CID 75500466
imidazo[1,2-a]pyridin-2-ylmethyl 2,5-dimethyl-1-(4-methylphenyl)pyrrole-3-carboxylate
CID 7173026
imidazo[1,2-a]pyridin-2-ylmethyl 2-amino-4-chlorobenzoate
CID 60656920
imidazo[1,2-a]pyridin-2-ylmethyl 2-amino-5-fluorobenzoate
CID 60656851
imidazo[1,2-a]pyridin-2-ylmethyl 2-piperidin-1-ylsulfonylbenzoate
CID 7626180
2-O-ethyl 4-O-(imidazo[1,2-a]pyridin-2-ylmethyl) 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate
CID 7173028
(3-nitrophenyl)methyl 2-(5-methyl-1,3,4-oxadiazol-2-yl)benzoate
CID 99821157
imidazo[1,2-a]pyridin-2-ylmethyl quinoxaline-2-carboxylate
CID 71944439
ethyl 2-(5-phenyl-1,3,4-oxadiazol-2-yl)benzoate
CID 54008795

Frequently Asked Questions

What is the IUPAC name of imidazo[1,2-a]pyridin-2-ylmethyl 2-(5-methyl-1,3,4-oxadiazol-2-yl)benzoate?
The IUPAC name of imidazo[1,2-a]pyridin-2-ylmethyl 2-(5-methyl-1,3,4-oxadiazol-2-yl)benzoate (CID 75500455) is imidazo[1,2-a]pyridin-2-ylmethyl 2-(5-methyl-1,3,4-oxadiazol-2-yl)benzoate.
What is the SMILES notation for imidazo[1,2-a]pyridin-2-ylmethyl 2-(5-methyl-1,3,4-oxadiazol-2-yl)benzoate?
The canonical SMILES for imidazo[1,2-a]pyridin-2-ylmethyl 2-(5-methyl-1,3,4-oxadiazol-2-yl)benzoate is Cc1nnc(-c2ccccc2C(=O)OCc2cn3ccccc3n2)o1.
What is the InChIKey of imidazo[1,2-a]pyridin-2-ylmethyl 2-(5-methyl-1,3,4-oxadiazol-2-yl)benzoate?
The InChIKey is QWZQSWFYENSQKS-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H14N4O3/c1-12-20-21-17(25-12)14-6-2-3-7-15(14)18(23)24-11-13-10-22-9-5-4-8-16(22)19-13/h2-10H,11H2,1H3.
What are the key properties of imidazo[1,2-a]pyridin-2-ylmethyl 2-(5-methyl-1,3,4-oxadiazol-2-yl)benzoate?
imidazo[1,2-a]pyridin-2-ylmethyl 2-(5-methyl-1,3,4-oxadiazol-2-yl)benzoate has a molecular weight of 334.34 g/mol, XLogP of 3.05, 4 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for imidazo[1,2-a]pyridin-2-ylmethyl 2-(5-methyl-1,3,4-oxadiazol-2-yl)benzoate is sourced from PubChem (CID 75500455), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).