1-methoxy-2,2-diphenylindol-3-one

C21H17NO2 — CID 12809019

IUPAC1-methoxy-2,2-diphenylindol-3-one
SMILESCON1c2ccccc2C(=O)C1(c1ccccc1)c1ccccc1
InChIInChI=1S/C21H17NO2/c1-24-22-19-15-9-8-14-18(19)20(23)21(22,16-10-4-2-5-11-16)17-12-6-3-7-13-17/h2-15H,1H3
InChIKeyYRBCAEDCYKDCAX-UHFFFAOYSA-N
MW315.37 g/mol
LogP4.19
Rot. Bonds3

About 1-methoxy-2,2-diphenylindol-3-one

1-methoxy-2,2-diphenylindol-3-one (PubChem CID 12809019) has the molecular formula C21H17NO2 and a molecular weight of 315.37 g/mol. Its IUPAC name is 1-methoxy-2,2-diphenylindol-3-one.

Molecular Properties

Compound Name1-methoxy-2,2-diphenylindol-3-one
PubChem CID12809019
Molecular FormulaC21H17NO2
Molecular Weight315.37 g/mol
Exact Mass315.13
IUPAC Name1-methoxy-2,2-diphenylindol-3-one
SMILESCON1c2ccccc2C(=O)C1(c1ccccc1)c1ccccc1
InChIInChI=1S/C21H17NO2/c1-24-22-19-15-9-8-14-18(19)20(23)21(22,16-10-4-2-5-11-16)17-12-6-3-7-13-17/h2-15H,1H3
InChIKeyYRBCAEDCYKDCAX-UHFFFAOYSA-N
XLogP4.19
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500315.37
LogP ≤ 54.19
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-methoxy-2,2-diphenylindol-3-one?
The IUPAC name of 1-methoxy-2,2-diphenylindol-3-one (CID 12809019) is 1-methoxy-2,2-diphenylindol-3-one.
What is the SMILES notation for 1-methoxy-2,2-diphenylindol-3-one?
The canonical SMILES for 1-methoxy-2,2-diphenylindol-3-one is CON1c2ccccc2C(=O)C1(c1ccccc1)c1ccccc1.
What is the InChIKey of 1-methoxy-2,2-diphenylindol-3-one?
The InChIKey is YRBCAEDCYKDCAX-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H17NO2/c1-24-22-19-15-9-8-14-18(19)20(23)21(22,16-10-4-2-5-11-16)17-12-6-3-7-13-17/h2-15H,1H3.
What are the key properties of 1-methoxy-2,2-diphenylindol-3-one?
1-methoxy-2,2-diphenylindol-3-one has a molecular weight of 315.37 g/mol, XLogP of 4.19, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methoxy-2,2-diphenylindol-3-one is sourced from PubChem (CID 12809019), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).