2-(3-benzoylindol-1-yl)-N-(3-methoxyphenyl)acetamide

C24H20N2O3 — CID 4043147

IUPAC2-(3-benzoylindol-1-yl)-N-(3-methoxyphenyl)acetamide
SMILESCOc1cccc(NC(=O)Cn2cc(C(=O)c3ccccc3)c3ccccc32)c1
InChIInChI=1S/C24H20N2O3/c1-29-19-11-7-10-18(14-19)25-23(27)16-26-15-21(20-12-5-6-13-22(20)26)24(28)17-8-3-2-4-9-17/h2-15H,16H2,1H3,(H,25,27)
InChIKeyUZCNWFMPVOQZLE-UHFFFAOYSA-N
MW384.44 g/mol
LogP4.52
Rot. Bonds6

About 2-(3-benzoylindol-1-yl)-N-(3-methoxyphenyl)acetamide

2-(3-benzoylindol-1-yl)-N-(3-methoxyphenyl)acetamide (PubChem CID 4043147) has the molecular formula C24H20N2O3 and a molecular weight of 384.44 g/mol. Its IUPAC name is 2-(3-benzoylindol-1-yl)-N-(3-methoxyphenyl)acetamide.

Molecular Properties

Compound Name2-(3-benzoylindol-1-yl)-N-(3-methoxyphenyl)acetamide
PubChem CID4043147
Molecular FormulaC24H20N2O3
Molecular Weight384.44 g/mol
Exact Mass384.15
IUPAC Name2-(3-benzoylindol-1-yl)-N-(3-methoxyphenyl)acetamide
SMILESCOc1cccc(NC(=O)Cn2cc(C(=O)c3ccccc3)c3ccccc32)c1
InChIInChI=1S/C24H20N2O3/c1-29-19-11-7-10-18(14-19)25-23(27)16-26-15-21(20-12-5-6-13-22(20)26)24(28)17-8-3-2-4-9-17/h2-15H,16H2,1H3,(H,25,27)
InChIKeyUZCNWFMPVOQZLE-UHFFFAOYSA-N
XLogP4.52
TPSA60.33 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500384.44
LogP ≤ 54.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(3-benzoylindol-1-yl)-N-(3-methoxyphenyl)acetamide?
The IUPAC name of 2-(3-benzoylindol-1-yl)-N-(3-methoxyphenyl)acetamide (CID 4043147) is 2-(3-benzoylindol-1-yl)-N-(3-methoxyphenyl)acetamide.
What is the SMILES notation for 2-(3-benzoylindol-1-yl)-N-(3-methoxyphenyl)acetamide?
The canonical SMILES for 2-(3-benzoylindol-1-yl)-N-(3-methoxyphenyl)acetamide is COc1cccc(NC(=O)Cn2cc(C(=O)c3ccccc3)c3ccccc32)c1.
What is the InChIKey of 2-(3-benzoylindol-1-yl)-N-(3-methoxyphenyl)acetamide?
The InChIKey is UZCNWFMPVOQZLE-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H20N2O3/c1-29-19-11-7-10-18(14-19)25-23(27)16-26-15-21(20-12-5-6-13-22(20)26)24(28)17-8-3-2-4-9-17/h2-15H,16H2,1H3,(H,25,27).
What are the key properties of 2-(3-benzoylindol-1-yl)-N-(3-methoxyphenyl)acetamide?
2-(3-benzoylindol-1-yl)-N-(3-methoxyphenyl)acetamide has a molecular weight of 384.44 g/mol, XLogP of 4.52, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-benzoylindol-1-yl)-N-(3-methoxyphenyl)acetamide is sourced from PubChem (CID 4043147), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).