5-(6-methoxy-2-phenyl-1H-indol-5-yl)-1,3-oxazole

C18H14N2O2 — CID 22238483

IUPAC5-(6-methoxy-2-phenyl-1H-indol-5-yl)-1,3-oxazole
SMILESCOc1cc2[nH]c(-c3ccccc3)cc2cc1-c1cnco1
InChIInChI=1S/C18H14N2O2/c1-21-17-9-16-13(7-14(17)18-10-19-11-22-18)8-15(20-16)12-5-3-2-4-6-12/h2-11,20H,1H3
InChIKeyBESGGLGAKGKEOC-UHFFFAOYSA-N
MW290.32 g/mol
LogP4.50
Rot. Bonds3

About 5-(6-methoxy-2-phenyl-1H-indol-5-yl)-1,3-oxazole

5-(6-methoxy-2-phenyl-1H-indol-5-yl)-1,3-oxazole (PubChem CID 22238483) has the molecular formula C18H14N2O2 and a molecular weight of 290.32 g/mol. Its IUPAC name is 5-(6-methoxy-2-phenyl-1H-indol-5-yl)-1,3-oxazole.

Molecular Properties

Compound Name5-(6-methoxy-2-phenyl-1H-indol-5-yl)-1,3-oxazole
PubChem CID22238483
Molecular FormulaC18H14N2O2
Molecular Weight290.32 g/mol
Exact Mass290.11
IUPAC Name5-(6-methoxy-2-phenyl-1H-indol-5-yl)-1,3-oxazole
SMILESCOc1cc2[nH]c(-c3ccccc3)cc2cc1-c1cnco1
InChIInChI=1S/C18H14N2O2/c1-21-17-9-16-13(7-14(17)18-10-19-11-22-18)8-15(20-16)12-5-3-2-4-6-12/h2-11,20H,1H3
InChIKeyBESGGLGAKGKEOC-UHFFFAOYSA-N
XLogP4.50
TPSA51.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.32
LogP ≤ 54.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-(6-methoxy-2-phenyl-1H-indol-5-yl)-1,3-oxazole?
The IUPAC name of 5-(6-methoxy-2-phenyl-1H-indol-5-yl)-1,3-oxazole (CID 22238483) is 5-(6-methoxy-2-phenyl-1H-indol-5-yl)-1,3-oxazole.
What is the SMILES notation for 5-(6-methoxy-2-phenyl-1H-indol-5-yl)-1,3-oxazole?
The canonical SMILES for 5-(6-methoxy-2-phenyl-1H-indol-5-yl)-1,3-oxazole is COc1cc2[nH]c(-c3ccccc3)cc2cc1-c1cnco1.
What is the InChIKey of 5-(6-methoxy-2-phenyl-1H-indol-5-yl)-1,3-oxazole?
The InChIKey is BESGGLGAKGKEOC-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H14N2O2/c1-21-17-9-16-13(7-14(17)18-10-19-11-22-18)8-15(20-16)12-5-3-2-4-6-12/h2-11,20H,1H3.
What are the key properties of 5-(6-methoxy-2-phenyl-1H-indol-5-yl)-1,3-oxazole?
5-(6-methoxy-2-phenyl-1H-indol-5-yl)-1,3-oxazole has a molecular weight of 290.32 g/mol, XLogP of 4.50, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(6-methoxy-2-phenyl-1H-indol-5-yl)-1,3-oxazole is sourced from PubChem (CID 22238483), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).