imidazo[1,2-a]pyridin-2-ylmethyl 2-(6-methyl-2,4-dioxo-1H-pyrimidin-5-yl)acetate

C15H14N4O4 — CID 90480627

IUPACimidazo[1,2-a]pyridin-2-ylmethyl 2-(6-methyl-2,4-dioxo-1H-pyrimidin-5-yl)acetate
SMILESCc1[nH]c(=O)[nH]c(=O)c1CC(=O)OCc1cn2ccccc2n1
InChIInChI=1S/C15H14N4O4/c1-9-11(14(21)18-15(22)16-9)6-13(20)23-8-10-7-19-5-3-2-4-12(19)17-10/h2-5,7H,6,8H2,1H3,(H2,16,18,21,22)
InChIKeyYXDLJJFPTONXNR-UHFFFAOYSA-N
MW314.30 g/mol
LogP0.31
Rot. Bonds4

About imidazo[1,2-a]pyridin-2-ylmethyl 2-(6-methyl-2,4-dioxo-1H-pyrimidin-5-yl)acetate

imidazo[1,2-a]pyridin-2-ylmethyl 2-(6-methyl-2,4-dioxo-1H-pyrimidin-5-yl)acetate (PubChem CID 90480627) has the molecular formula C15H14N4O4 and a molecular weight of 314.30 g/mol. Its IUPAC name is imidazo[1,2-a]pyridin-2-ylmethyl 2-(6-methyl-2,4-dioxo-1H-pyrimidin-5-yl)acetate.

Molecular Properties

Compound Nameimidazo[1,2-a]pyridin-2-ylmethyl 2-(6-methyl-2,4-dioxo-1H-pyrimidin-5-yl)acetate
PubChem CID90480627
Molecular FormulaC15H14N4O4
Molecular Weight314.30 g/mol
Exact Mass314.10
IUPAC Nameimidazo[1,2-a]pyridin-2-ylmethyl 2-(6-methyl-2,4-dioxo-1H-pyrimidin-5-yl)acetate
SMILESCc1[nH]c(=O)[nH]c(=O)c1CC(=O)OCc1cn2ccccc2n1
InChIInChI=1S/C15H14N4O4/c1-9-11(14(21)18-15(22)16-9)6-13(20)23-8-10-7-19-5-3-2-4-12(19)17-10/h2-5,7H,6,8H2,1H3,(H2,16,18,21,22)
InChIKeyYXDLJJFPTONXNR-UHFFFAOYSA-N
XLogP0.31
TPSA109.32 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500314.30
LogP ≤ 50.31
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze imidazo[1,2-a]pyridin-2-ylmethyl 2-(6-methyl-2,4-dioxo-1H-pyrimidin-5-yl)acetate with MolForge

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Related Compounds

imidazo[1,2-a]pyridin-2-ylmethyl 4-(methylsulfonylmethyl)benzoate
CID 7625039
2-O-ethyl 4-O-(imidazo[1,2-a]pyridin-2-ylmethyl) 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate
CID 7173028
imidazo[1,2-a]pyridin-2-ylmethyl 2-[(3,5-dimethyl-1,2-oxazol-4-yl)methylsulfanyl]acetate
CID 7250479
imidazo[1,2-a]pyridin-2-ylmethyl 2-(6-hydroxy-1-benzofuran-3-yl)acetate
CID 7250978
3-(imidazo[1,2-a]pyridin-2-ylmethoxy)-2-methylbenzoic acid
CID 82810212
imidazo[1,2-a]pyridin-2-ylmethyl 4-aminobenzoate
CID 60655585
imidazo[1,2-a]pyridin-2-ylmethyl 2-[2-(2-oxopyrrolidin-1-yl)-1,3-thiazol-4-yl]acetate
CID 55403684
ethyl 3-(imidazo[1,2-a]pyridin-2-ylmethoxy)benzoate
CID 112788039
imidazo[1,2-a]pyridin-2-ylmethyl 2-(5-methyl-1,3,4-oxadiazol-2-yl)benzoate
CID 75500455
ethyl 2-[4-(imidazo[1,2-a]pyridin-2-ylmethyl)piperazin-1-yl]acetate
CID 134031725
imidazo[1,2-a]pyridin-2-ylmethyl 1-amino-9,10-dioxoanthracene-2-carboxylate
CID 55372410
2-(phenoxymethyl)imidazo[1,2-a]pyridine
CID 4702052

Frequently Asked Questions

What is the IUPAC name of imidazo[1,2-a]pyridin-2-ylmethyl 2-(6-methyl-2,4-dioxo-1H-pyrimidin-5-yl)acetate?
The IUPAC name of imidazo[1,2-a]pyridin-2-ylmethyl 2-(6-methyl-2,4-dioxo-1H-pyrimidin-5-yl)acetate (CID 90480627) is imidazo[1,2-a]pyridin-2-ylmethyl 2-(6-methyl-2,4-dioxo-1H-pyrimidin-5-yl)acetate.
What is the SMILES notation for imidazo[1,2-a]pyridin-2-ylmethyl 2-(6-methyl-2,4-dioxo-1H-pyrimidin-5-yl)acetate?
The canonical SMILES for imidazo[1,2-a]pyridin-2-ylmethyl 2-(6-methyl-2,4-dioxo-1H-pyrimidin-5-yl)acetate is Cc1[nH]c(=O)[nH]c(=O)c1CC(=O)OCc1cn2ccccc2n1.
What is the InChIKey of imidazo[1,2-a]pyridin-2-ylmethyl 2-(6-methyl-2,4-dioxo-1H-pyrimidin-5-yl)acetate?
The InChIKey is YXDLJJFPTONXNR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14N4O4/c1-9-11(14(21)18-15(22)16-9)6-13(20)23-8-10-7-19-5-3-2-4-12(19)17-10/h2-5,7H,6,8H2,1H3,(H2,16,18,21,22).
What are the key properties of imidazo[1,2-a]pyridin-2-ylmethyl 2-(6-methyl-2,4-dioxo-1H-pyrimidin-5-yl)acetate?
imidazo[1,2-a]pyridin-2-ylmethyl 2-(6-methyl-2,4-dioxo-1H-pyrimidin-5-yl)acetate has a molecular weight of 314.30 g/mol, XLogP of 0.31, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for imidazo[1,2-a]pyridin-2-ylmethyl 2-(6-methyl-2,4-dioxo-1H-pyrimidin-5-yl)acetate is sourced from PubChem (CID 90480627), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).