(2-oxooxolan-3-yl) 2-(2-phenylindol-1-yl)acetate

C20H17NO4 — CID 75412934

IUPAC(2-oxooxolan-3-yl) 2-(2-phenylindol-1-yl)acetate
SMILESO=C(Cn1c(-c2ccccc2)cc2ccccc21)OC1CCOC1=O
InChIInChI=1S/C20H17NO4/c22-19(25-18-10-11-24-20(18)23)13-21-16-9-5-4-8-15(16)12-17(21)14-6-2-1-3-7-14/h1-9,12,18H,10-11,13H2
InChIKeyZYQGCZZNOALHLW-UHFFFAOYSA-N
MW335.36 g/mol
LogP3.17
Rot. Bonds4

About (2-oxooxolan-3-yl) 2-(2-phenylindol-1-yl)acetate

(2-oxooxolan-3-yl) 2-(2-phenylindol-1-yl)acetate (PubChem CID 75412934) has the molecular formula C20H17NO4 and a molecular weight of 335.36 g/mol. Its IUPAC name is (2-oxooxolan-3-yl) 2-(2-phenylindol-1-yl)acetate.

Molecular Properties

Compound Name(2-oxooxolan-3-yl) 2-(2-phenylindol-1-yl)acetate
PubChem CID75412934
Molecular FormulaC20H17NO4
Molecular Weight335.36 g/mol
Exact Mass335.12
IUPAC Name(2-oxooxolan-3-yl) 2-(2-phenylindol-1-yl)acetate
SMILESO=C(Cn1c(-c2ccccc2)cc2ccccc21)OC1CCOC1=O
InChIInChI=1S/C20H17NO4/c22-19(25-18-10-11-24-20(18)23)13-21-16-9-5-4-8-15(16)12-17(21)14-6-2-1-3-7-14/h1-9,12,18H,10-11,13H2
InChIKeyZYQGCZZNOALHLW-UHFFFAOYSA-N
XLogP3.17
TPSA57.53 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500335.36
LogP ≤ 53.17
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of (2-oxooxolan-3-yl) 2-(2-phenylindol-1-yl)acetate?
The IUPAC name of (2-oxooxolan-3-yl) 2-(2-phenylindol-1-yl)acetate (CID 75412934) is (2-oxooxolan-3-yl) 2-(2-phenylindol-1-yl)acetate.
What is the SMILES notation for (2-oxooxolan-3-yl) 2-(2-phenylindol-1-yl)acetate?
The canonical SMILES for (2-oxooxolan-3-yl) 2-(2-phenylindol-1-yl)acetate is O=C(Cn1c(-c2ccccc2)cc2ccccc21)OC1CCOC1=O.
What is the InChIKey of (2-oxooxolan-3-yl) 2-(2-phenylindol-1-yl)acetate?
The InChIKey is ZYQGCZZNOALHLW-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H17NO4/c22-19(25-18-10-11-24-20(18)23)13-21-16-9-5-4-8-15(16)12-17(21)14-6-2-1-3-7-14/h1-9,12,18H,10-11,13H2.
What are the key properties of (2-oxooxolan-3-yl) 2-(2-phenylindol-1-yl)acetate?
(2-oxooxolan-3-yl) 2-(2-phenylindol-1-yl)acetate has a molecular weight of 335.36 g/mol, XLogP of 3.17, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (2-oxooxolan-3-yl) 2-(2-phenylindol-1-yl)acetate is sourced from PubChem (CID 75412934), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).