methyl 2-(5-ethyl-3-methyl-1,2-oxazol-4-yl)-6-methoxypyridine-3-carboxylate

C14H16N2O4 — CID 67990153

IUPACmethyl 2-(5-ethyl-3-methyl-1,2-oxazol-4-yl)-6-methoxypyridine-3-carboxylate
SMILESCCc1onc(C)c1-c1nc(OC)ccc1C(=O)OC
InChIInChI=1S/C14H16N2O4/c1-5-10-12(8(2)16-20-10)13-9(14(17)19-4)6-7-11(15-13)18-3/h6-7H,5H2,1-4H3
InChIKeyFZYJKDIFNRVHFF-UHFFFAOYSA-N
MW276.29 g/mol
LogP2.40
Rot. Bonds4

About methyl 2-(5-ethyl-3-methyl-1,2-oxazol-4-yl)-6-methoxypyridine-3-carboxylate

methyl 2-(5-ethyl-3-methyl-1,2-oxazol-4-yl)-6-methoxypyridine-3-carboxylate (PubChem CID 67990153) has the molecular formula C14H16N2O4 and a molecular weight of 276.29 g/mol. Its IUPAC name is methyl 2-(5-ethyl-3-methyl-1,2-oxazol-4-yl)-6-methoxypyridine-3-carboxylate.

Molecular Properties

Compound Namemethyl 2-(5-ethyl-3-methyl-1,2-oxazol-4-yl)-6-methoxypyridine-3-carboxylate
PubChem CID67990153
Molecular FormulaC14H16N2O4
Molecular Weight276.29 g/mol
Exact Mass276.11
IUPAC Namemethyl 2-(5-ethyl-3-methyl-1,2-oxazol-4-yl)-6-methoxypyridine-3-carboxylate
SMILESCCc1onc(C)c1-c1nc(OC)ccc1C(=O)OC
InChIInChI=1S/C14H16N2O4/c1-5-10-12(8(2)16-20-10)13-9(14(17)19-4)6-7-11(15-13)18-3/h6-7H,5H2,1-4H3
InChIKeyFZYJKDIFNRVHFF-UHFFFAOYSA-N
XLogP2.40
TPSA74.45 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.29
LogP ≤ 52.40
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Related Compounds

methyl 2-methoxy-8-methylquinoline-5-carboxylate
CID 86241626
methyl 5-chloro-2-[5-(hydroxymethyl)-3-methyl-1,2-oxazol-4-yl]benzoate
CID 118093352
methyl 2-ethyl-5-(4-methoxyphenyl)furan-3-carboxylate
CID 68514199
methyl 2-(ethoxycarbonylcarbamothioylamino)-6-methoxypyridine-3-carboxylate
CID 121002980
methyl 3-(3,5-dimethyl-1,2-oxazol-4-yl)benzoate
CID 101483431
dimethyl 2,3-dimethoxybenzene-1,4-dicarboxylate
CID 10682339
methyl 2-methoxy-8-(oxiran-2-yl)quinoline-5-carboxylate
CID 86241636
methyl 8-[7-(3,5-dimethyl-1,2-oxazol-4-yl)-2-ethyl-6-methoxy-9H-pyrimido[4,5-b]indol-4-yl]-2,3-dihydro-1,4-benzodioxine-5-carboxylate
CID 131974225
methyl 5-(aminomethyl)-3-methyl-1,2-oxazole-4-carboxylate
CID 105434387
methyl 6-chloro-2-(2,3,4,5,6-pentachlorophenyl)pyridine-3-carboxylate
CID 134637790
methyl 5-(3,5-dimethyl-1,2-oxazol-4-yl)-2-[(4-methylphenyl)methyl]benzoate
CID 147155433
13-methoxy-3-methyl-5-oxa-4,8,14-triazatricyclo[8.4.0.02,6]tetradeca-1(10),2(6),3,11,13-pentaen-9-one
CID 67814096

Frequently Asked Questions

What is the IUPAC name of methyl 2-(5-ethyl-3-methyl-1,2-oxazol-4-yl)-6-methoxypyridine-3-carboxylate?
The IUPAC name of methyl 2-(5-ethyl-3-methyl-1,2-oxazol-4-yl)-6-methoxypyridine-3-carboxylate (CID 67990153) is methyl 2-(5-ethyl-3-methyl-1,2-oxazol-4-yl)-6-methoxypyridine-3-carboxylate.
What is the SMILES notation for methyl 2-(5-ethyl-3-methyl-1,2-oxazol-4-yl)-6-methoxypyridine-3-carboxylate?
The canonical SMILES for methyl 2-(5-ethyl-3-methyl-1,2-oxazol-4-yl)-6-methoxypyridine-3-carboxylate is CCc1onc(C)c1-c1nc(OC)ccc1C(=O)OC.
What is the InChIKey of methyl 2-(5-ethyl-3-methyl-1,2-oxazol-4-yl)-6-methoxypyridine-3-carboxylate?
The InChIKey is FZYJKDIFNRVHFF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N2O4/c1-5-10-12(8(2)16-20-10)13-9(14(17)19-4)6-7-11(15-13)18-3/h6-7H,5H2,1-4H3.
What are the key properties of methyl 2-(5-ethyl-3-methyl-1,2-oxazol-4-yl)-6-methoxypyridine-3-carboxylate?
methyl 2-(5-ethyl-3-methyl-1,2-oxazol-4-yl)-6-methoxypyridine-3-carboxylate has a molecular weight of 276.29 g/mol, XLogP of 2.40, 4 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 2-(5-ethyl-3-methyl-1,2-oxazol-4-yl)-6-methoxypyridine-3-carboxylate is sourced from PubChem (CID 67990153), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).