4-indol-1-yl-4-oxo-N-(2-phenoxyphenyl)butanamide

C24H20N2O3 — CID 84552848

IUPAC4-indol-1-yl-4-oxo-N-(2-phenoxyphenyl)butanamide
SMILESO=C(CCC(=O)n1ccc2ccccc21)Nc1ccccc1Oc1ccccc1
InChIInChI=1S/C24H20N2O3/c27-23(14-15-24(28)26-17-16-18-8-4-6-12-21(18)26)25-20-11-5-7-13-22(20)29-19-9-2-1-3-10-19/h1-13,16-17H,14-15H2,(H,25,27)
InChIKeyWRAOSDUYULHKCJ-UHFFFAOYSA-N
MW384.44 g/mol
LogP5.49
Rot. Bonds6

About 4-indol-1-yl-4-oxo-N-(2-phenoxyphenyl)butanamide

4-indol-1-yl-4-oxo-N-(2-phenoxyphenyl)butanamide (PubChem CID 84552848) has the molecular formula C24H20N2O3 and a molecular weight of 384.44 g/mol. Its IUPAC name is 4-indol-1-yl-4-oxo-N-(2-phenoxyphenyl)butanamide.

Molecular Properties

Compound Name4-indol-1-yl-4-oxo-N-(2-phenoxyphenyl)butanamide
PubChem CID84552848
Molecular FormulaC24H20N2O3
Molecular Weight384.44 g/mol
Exact Mass384.15
IUPAC Name4-indol-1-yl-4-oxo-N-(2-phenoxyphenyl)butanamide
SMILESO=C(CCC(=O)n1ccc2ccccc21)Nc1ccccc1Oc1ccccc1
InChIInChI=1S/C24H20N2O3/c27-23(14-15-24(28)26-17-16-18-8-4-6-12-21(18)26)25-20-11-5-7-13-22(20)29-19-9-2-1-3-10-19/h1-13,16-17H,14-15H2,(H,25,27)
InChIKeyWRAOSDUYULHKCJ-UHFFFAOYSA-N
XLogP5.49
TPSA60.33 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500384.44
LogP ≤ 55.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 4-indol-1-yl-4-oxo-N-(2-phenoxyphenyl)butanamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(2,5-dimethylphenyl)-4-indol-1-yl-4-oxobutanamide
CID 84552820
4-indol-1-yl-N-methyl-4-oxobutanamide
CID 84556822
5-bromo-2-[(4-indol-1-yl-4-oxobutanoyl)amino]benzoic acid
CID 84553070
N-(2-phenoxyphenyl)-2-phenylacetamide
CID 1121260
4-[(4-indol-1-yl-4-oxobutanoyl)amino]butanoic acid
CID 84556637
N-(3,4-dichlorophenyl)-4-indol-1-yl-4-oxobutanamide
CID 84552815
N-(2-phenoxyphenyl)decanamide
CID 4091110
4-(5-methylthiophen-2-yl)-4-oxo-N-(2-phenoxyphenyl)butanamide
CID 33251204
N-(4-chloro-2-nitrophenyl)-4-indol-1-yl-4-oxobutanamide
CID 84553097
4-indol-1-yl-4-oxobutanamide
CID 84553197
N-(2-phenoxyphenyl)-3-(propan-2-ylamino)propanamide
CID 109011722
N-[3-oxo-3-(2-phenoxyanilino)propyl]naphthalene-1-carboxamide
CID 169183116

Frequently Asked Questions

What is the IUPAC name of 4-indol-1-yl-4-oxo-N-(2-phenoxyphenyl)butanamide?
The IUPAC name of 4-indol-1-yl-4-oxo-N-(2-phenoxyphenyl)butanamide (CID 84552848) is 4-indol-1-yl-4-oxo-N-(2-phenoxyphenyl)butanamide.
What is the SMILES notation for 4-indol-1-yl-4-oxo-N-(2-phenoxyphenyl)butanamide?
The canonical SMILES for 4-indol-1-yl-4-oxo-N-(2-phenoxyphenyl)butanamide is O=C(CCC(=O)n1ccc2ccccc21)Nc1ccccc1Oc1ccccc1.
What is the InChIKey of 4-indol-1-yl-4-oxo-N-(2-phenoxyphenyl)butanamide?
The InChIKey is WRAOSDUYULHKCJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H20N2O3/c27-23(14-15-24(28)26-17-16-18-8-4-6-12-21(18)26)25-20-11-5-7-13-22(20)29-19-9-2-1-3-10-19/h1-13,16-17H,14-15H2,(H,25,27).
What are the key properties of 4-indol-1-yl-4-oxo-N-(2-phenoxyphenyl)butanamide?
4-indol-1-yl-4-oxo-N-(2-phenoxyphenyl)butanamide has a molecular weight of 384.44 g/mol, XLogP of 5.49, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-indol-1-yl-4-oxo-N-(2-phenoxyphenyl)butanamide is sourced from PubChem (CID 84552848), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).