7-methoxy-4-(1-oxo-2,3-dihydroinden-5-yl)-1,3-dihydroindol-2-one

C18H15NO3 — CID 154848998

IUPAC7-methoxy-4-(1-oxo-2,3-dihydroinden-5-yl)-1,3-dihydroindol-2-one
SMILESCOc1ccc(-c2ccc3c(c2)CCC3=O)c2c1NC(=O)C2
InChIInChI=1S/C18H15NO3/c1-22-16-7-5-12(14-9-17(21)19-18(14)16)10-2-4-13-11(8-10)3-6-15(13)20/h2,4-5,7-8H,3,6,9H2,1H3,(H,19,21)
InChIKeyOIFSQCJMEKUJAI-UHFFFAOYSA-N
MW293.32 g/mol
LogP2.99
Rot. Bonds2

About 7-methoxy-4-(1-oxo-2,3-dihydroinden-5-yl)-1,3-dihydroindol-2-one

7-methoxy-4-(1-oxo-2,3-dihydroinden-5-yl)-1,3-dihydroindol-2-one (PubChem CID 154848998) has the molecular formula C18H15NO3 and a molecular weight of 293.32 g/mol. Its IUPAC name is 7-methoxy-4-(1-oxo-2,3-dihydroinden-5-yl)-1,3-dihydroindol-2-one.

Molecular Properties

Compound Name7-methoxy-4-(1-oxo-2,3-dihydroinden-5-yl)-1,3-dihydroindol-2-one
PubChem CID154848998
Molecular FormulaC18H15NO3
Molecular Weight293.32 g/mol
Exact Mass293.11
IUPAC Name7-methoxy-4-(1-oxo-2,3-dihydroinden-5-yl)-1,3-dihydroindol-2-one
SMILESCOc1ccc(-c2ccc3c(c2)CCC3=O)c2c1NC(=O)C2
InChIInChI=1S/C18H15NO3/c1-22-16-7-5-12(14-9-17(21)19-18(14)16)10-2-4-13-11(8-10)3-6-15(13)20/h2,4-5,7-8H,3,6,9H2,1H3,(H,19,21)
InChIKeyOIFSQCJMEKUJAI-UHFFFAOYSA-N
XLogP2.99
TPSA55.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.32
LogP ≤ 52.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 7-methoxy-4-(1-oxo-2,3-dihydroinden-5-yl)-1,3-dihydroindol-2-one?
The IUPAC name of 7-methoxy-4-(1-oxo-2,3-dihydroinden-5-yl)-1,3-dihydroindol-2-one (CID 154848998) is 7-methoxy-4-(1-oxo-2,3-dihydroinden-5-yl)-1,3-dihydroindol-2-one.
What is the SMILES notation for 7-methoxy-4-(1-oxo-2,3-dihydroinden-5-yl)-1,3-dihydroindol-2-one?
The canonical SMILES for 7-methoxy-4-(1-oxo-2,3-dihydroinden-5-yl)-1,3-dihydroindol-2-one is COc1ccc(-c2ccc3c(c2)CCC3=O)c2c1NC(=O)C2.
What is the InChIKey of 7-methoxy-4-(1-oxo-2,3-dihydroinden-5-yl)-1,3-dihydroindol-2-one?
The InChIKey is OIFSQCJMEKUJAI-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H15NO3/c1-22-16-7-5-12(14-9-17(21)19-18(14)16)10-2-4-13-11(8-10)3-6-15(13)20/h2,4-5,7-8H,3,6,9H2,1H3,(H,19,21).
What are the key properties of 7-methoxy-4-(1-oxo-2,3-dihydroinden-5-yl)-1,3-dihydroindol-2-one?
7-methoxy-4-(1-oxo-2,3-dihydroinden-5-yl)-1,3-dihydroindol-2-one has a molecular weight of 293.32 g/mol, XLogP of 2.99, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 7-methoxy-4-(1-oxo-2,3-dihydroinden-5-yl)-1,3-dihydroindol-2-one is sourced from PubChem (CID 154848998), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).