(8-methylimidazo[1,2-a]pyridin-2-yl)methyl 1-hydroxynaphthalene-2-carboxylate

C20H16N2O3 — CID 16594565

IUPAC(8-methylimidazo[1,2-a]pyridin-2-yl)methyl 1-hydroxynaphthalene-2-carboxylate
SMILESCc1cccn2cc(COC(=O)c3ccc4ccccc4c3O)nc12
InChIInChI=1S/C20H16N2O3/c1-13-5-4-10-22-11-15(21-19(13)22)12-25-20(24)17-9-8-14-6-2-3-7-16(14)18(17)23/h2-11,23H,12H2,1H3
InChIKeyLMGISSZBGUWAQC-UHFFFAOYSA-N
MW332.36 g/mol
LogP3.86
Rot. Bonds3

About (8-methylimidazo[1,2-a]pyridin-2-yl)methyl 1-hydroxynaphthalene-2-carboxylate

(8-methylimidazo[1,2-a]pyridin-2-yl)methyl 1-hydroxynaphthalene-2-carboxylate (PubChem CID 16594565) has the molecular formula C20H16N2O3 and a molecular weight of 332.36 g/mol. Its IUPAC name is (8-methylimidazo[1,2-a]pyridin-2-yl)methyl 1-hydroxynaphthalene-2-carboxylate.

Molecular Properties

Compound Name(8-methylimidazo[1,2-a]pyridin-2-yl)methyl 1-hydroxynaphthalene-2-carboxylate
PubChem CID16594565
Molecular FormulaC20H16N2O3
Molecular Weight332.36 g/mol
Exact Mass332.12
IUPAC Name(8-methylimidazo[1,2-a]pyridin-2-yl)methyl 1-hydroxynaphthalene-2-carboxylate
SMILESCc1cccn2cc(COC(=O)c3ccc4ccccc4c3O)nc12
InChIInChI=1S/C20H16N2O3/c1-13-5-4-10-22-11-15(21-19(13)22)12-25-20(24)17-9-8-14-6-2-3-7-16(14)18(17)23/h2-11,23H,12H2,1H3
InChIKeyLMGISSZBGUWAQC-UHFFFAOYSA-N
XLogP3.86
TPSA63.83 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms25
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.36
LogP ≤ 53.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of (8-methylimidazo[1,2-a]pyridin-2-yl)methyl 1-hydroxynaphthalene-2-carboxylate?
The IUPAC name of (8-methylimidazo[1,2-a]pyridin-2-yl)methyl 1-hydroxynaphthalene-2-carboxylate (CID 16594565) is (8-methylimidazo[1,2-a]pyridin-2-yl)methyl 1-hydroxynaphthalene-2-carboxylate.
What is the SMILES notation for (8-methylimidazo[1,2-a]pyridin-2-yl)methyl 1-hydroxynaphthalene-2-carboxylate?
The canonical SMILES for (8-methylimidazo[1,2-a]pyridin-2-yl)methyl 1-hydroxynaphthalene-2-carboxylate is Cc1cccn2cc(COC(=O)c3ccc4ccccc4c3O)nc12.
What is the InChIKey of (8-methylimidazo[1,2-a]pyridin-2-yl)methyl 1-hydroxynaphthalene-2-carboxylate?
The InChIKey is LMGISSZBGUWAQC-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H16N2O3/c1-13-5-4-10-22-11-15(21-19(13)22)12-25-20(24)17-9-8-14-6-2-3-7-16(14)18(17)23/h2-11,23H,12H2,1H3.
What are the key properties of (8-methylimidazo[1,2-a]pyridin-2-yl)methyl 1-hydroxynaphthalene-2-carboxylate?
(8-methylimidazo[1,2-a]pyridin-2-yl)methyl 1-hydroxynaphthalene-2-carboxylate has a molecular weight of 332.36 g/mol, XLogP of 3.86, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (8-methylimidazo[1,2-a]pyridin-2-yl)methyl 1-hydroxynaphthalene-2-carboxylate is sourced from PubChem (CID 16594565), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).