4-(6-methoxy-3-pyridinyl)-5-methyl-3-(3,4,5-trimethoxyphenyl)-1,2-oxazole

C19H20N2O5 — CID 24761350

IUPAC4-(6-methoxy-3-pyridinyl)-5-methyl-3-(3,4,5-trimethoxyphenyl)-1,2-oxazole
SMILESCOc1ccc(-c2c(-c3cc(OC)c(OC)c(OC)c3)noc2C)cn1
InChIInChI=1S/C19H20N2O5/c1-11-17(12-6-7-16(24-4)20-10-12)18(21-26-11)13-8-14(22-2)19(25-5)15(9-13)23-3/h6-10H,1-5H3
InChIKeyLMVIEOCZRGXJTI-UHFFFAOYSA-N
MW356.38 g/mol
LogP3.75
Rot. Bonds6

About 4-(6-methoxy-3-pyridinyl)-5-methyl-3-(3,4,5-trimethoxyphenyl)-1,2-oxazole

4-(6-methoxy-3-pyridinyl)-5-methyl-3-(3,4,5-trimethoxyphenyl)-1,2-oxazole (PubChem CID 24761350) has the molecular formula C19H20N2O5 and a molecular weight of 356.38 g/mol. Its IUPAC name is 4-(6-methoxy-3-pyridinyl)-5-methyl-3-(3,4,5-trimethoxyphenyl)-1,2-oxazole.

Molecular Properties

Compound Name4-(6-methoxy-3-pyridinyl)-5-methyl-3-(3,4,5-trimethoxyphenyl)-1,2-oxazole
PubChem CID24761350
Molecular FormulaC19H20N2O5
Molecular Weight356.38 g/mol
Exact Mass356.14
IUPAC Name4-(6-methoxy-3-pyridinyl)-5-methyl-3-(3,4,5-trimethoxyphenyl)-1,2-oxazole
SMILESCOc1ccc(-c2c(-c3cc(OC)c(OC)c(OC)c3)noc2C)cn1
InChIInChI=1S/C19H20N2O5/c1-11-17(12-6-7-16(24-4)20-10-12)18(21-26-11)13-8-14(22-2)19(25-5)15(9-13)23-3/h6-10H,1-5H3
InChIKeyLMVIEOCZRGXJTI-UHFFFAOYSA-N
XLogP3.75
TPSA75.84 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds6
Heavy Atoms26
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500356.38
LogP ≤ 53.75
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 4-(6-methoxy-3-pyridinyl)-5-methyl-3-(3,4,5-trimethoxyphenyl)-1,2-oxazole?
The IUPAC name of 4-(6-methoxy-3-pyridinyl)-5-methyl-3-(3,4,5-trimethoxyphenyl)-1,2-oxazole (CID 24761350) is 4-(6-methoxy-3-pyridinyl)-5-methyl-3-(3,4,5-trimethoxyphenyl)-1,2-oxazole.
What is the SMILES notation for 4-(6-methoxy-3-pyridinyl)-5-methyl-3-(3,4,5-trimethoxyphenyl)-1,2-oxazole?
The canonical SMILES for 4-(6-methoxy-3-pyridinyl)-5-methyl-3-(3,4,5-trimethoxyphenyl)-1,2-oxazole is COc1ccc(-c2c(-c3cc(OC)c(OC)c(OC)c3)noc2C)cn1.
What is the InChIKey of 4-(6-methoxy-3-pyridinyl)-5-methyl-3-(3,4,5-trimethoxyphenyl)-1,2-oxazole?
The InChIKey is LMVIEOCZRGXJTI-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N2O5/c1-11-17(12-6-7-16(24-4)20-10-12)18(21-26-11)13-8-14(22-2)19(25-5)15(9-13)23-3/h6-10H,1-5H3.
What are the key properties of 4-(6-methoxy-3-pyridinyl)-5-methyl-3-(3,4,5-trimethoxyphenyl)-1,2-oxazole?
4-(6-methoxy-3-pyridinyl)-5-methyl-3-(3,4,5-trimethoxyphenyl)-1,2-oxazole has a molecular weight of 356.38 g/mol, XLogP of 3.75, 6 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(6-methoxy-3-pyridinyl)-5-methyl-3-(3,4,5-trimethoxyphenyl)-1,2-oxazole is sourced from PubChem (CID 24761350), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).