4-(2-ethoxy-4-pyridinyl)-3-(4-fluorophenyl)-5-methyl-1,2-oxazole

C17H15FN2O2 — CID 58659495

IUPAC4-(2-ethoxy-4-pyridinyl)-3-(4-fluorophenyl)-5-methyl-1,2-oxazole
SMILESCCOc1cc(-c2c(-c3ccc(F)cc3)noc2C)ccn1
InChIInChI=1S/C17H15FN2O2/c1-3-21-15-10-13(8-9-19-15)16-11(2)22-20-17(16)12-4-6-14(18)7-5-12/h4-10H,3H2,1-2H3
InChIKeyPCIVAUZQVAWBKI-UHFFFAOYSA-N
MW298.32 g/mol
LogP4.25
Rot. Bonds4

About 4-(2-ethoxy-4-pyridinyl)-3-(4-fluorophenyl)-5-methyl-1,2-oxazole

4-(2-ethoxy-4-pyridinyl)-3-(4-fluorophenyl)-5-methyl-1,2-oxazole (PubChem CID 58659495) has the molecular formula C17H15FN2O2 and a molecular weight of 298.32 g/mol. Its IUPAC name is 4-(2-ethoxy-4-pyridinyl)-3-(4-fluorophenyl)-5-methyl-1,2-oxazole.

Molecular Properties

Compound Name4-(2-ethoxy-4-pyridinyl)-3-(4-fluorophenyl)-5-methyl-1,2-oxazole
PubChem CID58659495
Molecular FormulaC17H15FN2O2
Molecular Weight298.32 g/mol
Exact Mass298.11
IUPAC Name4-(2-ethoxy-4-pyridinyl)-3-(4-fluorophenyl)-5-methyl-1,2-oxazole
SMILESCCOc1cc(-c2c(-c3ccc(F)cc3)noc2C)ccn1
InChIInChI=1S/C17H15FN2O2/c1-3-21-15-10-13(8-9-19-15)16-11(2)22-20-17(16)12-4-6-14(18)7-5-12/h4-10H,3H2,1-2H3
InChIKeyPCIVAUZQVAWBKI-UHFFFAOYSA-N
XLogP4.25
TPSA48.15 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.32
LogP ≤ 54.25
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

4-(2-bromo-4-pyridinyl)-5-methyl-3-phenyl-1,2-oxazole
CID 23435665
ethyl 4-[3-(4-fluorophenyl)-5-methyl-1,2-oxazol-4-yl]-1,3-thiazole-2-carboxylate
CID 58752264
2-ethoxy-4-(3-fluoro-2-pyridinyl)pyridine
CID 173296229
4-(4-fluorophenyl)-5-methyl-3-(4-nitrophenyl)-1,2-oxazole
CID 155538929
ethyl [3-(4-fluorophenyl)-5-methyl-1,2-oxazol-4-yl] carbonate
CID 90340996
N-ethyl-3-(4-fluorophenyl)-4-pyridin-4-yl-1,2-oxazol-5-amine
CID 139825921
3-(4-fluorophenyl)-5-methyl-4-(1-pyridin-3-ylimidazol-4-yl)-1,2-oxazole
CID 23725201
5-(3-ethoxy-2-pyridinyl)-3-(2-methoxy-4-pyridinyl)-1,2,4-oxadiazole
CID 75483087
4-(4-ethoxy-3-fluorophenyl)-5-methyl-1,2-oxazole-3-carboxylic acid
CID 82486560
2-ethoxy-4-[5-(4-fluorophenyl)-2-[4-(4-fluorophenyl)-5-(2-methoxy-4-pyridinyl)-1-piperidin-4-ylimidazol-2-yl]-3-piperidin-4-ylimidazol-4-yl]pyrimidine
CID 57118194
3-(4-fluorophenyl)-4-(4-methylphenyl)-1,2-oxazol-5-amine
CID 62830483
3-(4-fluorophenyl)-4-(3-methylphenyl)-1,2-oxazol-5-amine
CID 62829957

Frequently Asked Questions

What is the IUPAC name of 4-(2-ethoxy-4-pyridinyl)-3-(4-fluorophenyl)-5-methyl-1,2-oxazole?
The IUPAC name of 4-(2-ethoxy-4-pyridinyl)-3-(4-fluorophenyl)-5-methyl-1,2-oxazole (CID 58659495) is 4-(2-ethoxy-4-pyridinyl)-3-(4-fluorophenyl)-5-methyl-1,2-oxazole.
What is the SMILES notation for 4-(2-ethoxy-4-pyridinyl)-3-(4-fluorophenyl)-5-methyl-1,2-oxazole?
The canonical SMILES for 4-(2-ethoxy-4-pyridinyl)-3-(4-fluorophenyl)-5-methyl-1,2-oxazole is CCOc1cc(-c2c(-c3ccc(F)cc3)noc2C)ccn1.
What is the InChIKey of 4-(2-ethoxy-4-pyridinyl)-3-(4-fluorophenyl)-5-methyl-1,2-oxazole?
The InChIKey is PCIVAUZQVAWBKI-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15FN2O2/c1-3-21-15-10-13(8-9-19-15)16-11(2)22-20-17(16)12-4-6-14(18)7-5-12/h4-10H,3H2,1-2H3.
What are the key properties of 4-(2-ethoxy-4-pyridinyl)-3-(4-fluorophenyl)-5-methyl-1,2-oxazole?
4-(2-ethoxy-4-pyridinyl)-3-(4-fluorophenyl)-5-methyl-1,2-oxazole has a molecular weight of 298.32 g/mol, XLogP of 4.25, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-ethoxy-4-pyridinyl)-3-(4-fluorophenyl)-5-methyl-1,2-oxazole is sourced from PubChem (CID 58659495), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).