N-(2,4-difluoro-6-phenylphenyl)-2-(5-methoxyindol-1-yl)acetamide

C23H18F2N2O2 — CID 86843668

IUPACN-(2,4-difluoro-6-phenylphenyl)-2-(5-methoxyindol-1-yl)acetamide
SMILESCOc1ccc2c(ccn2CC(=O)Nc2c(F)cc(F)cc2-c2ccccc2)c1
InChIInChI=1S/C23H18F2N2O2/c1-29-18-7-8-21-16(11-18)9-10-27(21)14-22(28)26-23-19(12-17(24)13-20(23)25)15-5-3-2-4-6-15/h2-13H,14H2,1H3,(H,26,28)
InChIKeyPTCXCFDEDUIXOR-UHFFFAOYSA-N
MW392.41 g/mol
LogP5.23
Rot. Bonds5

About N-(2,4-difluoro-6-phenylphenyl)-2-(5-methoxyindol-1-yl)acetamide

N-(2,4-difluoro-6-phenylphenyl)-2-(5-methoxyindol-1-yl)acetamide (PubChem CID 86843668) has the molecular formula C23H18F2N2O2 and a molecular weight of 392.41 g/mol. Its IUPAC name is N-(2,4-difluoro-6-phenylphenyl)-2-(5-methoxyindol-1-yl)acetamide.

Molecular Properties

Compound NameN-(2,4-difluoro-6-phenylphenyl)-2-(5-methoxyindol-1-yl)acetamide
PubChem CID86843668
Molecular FormulaC23H18F2N2O2
Molecular Weight392.41 g/mol
Exact Mass392.13
IUPAC NameN-(2,4-difluoro-6-phenylphenyl)-2-(5-methoxyindol-1-yl)acetamide
SMILESCOc1ccc2c(ccn2CC(=O)Nc2c(F)cc(F)cc2-c2ccccc2)c1
InChIInChI=1S/C23H18F2N2O2/c1-29-18-7-8-21-16(11-18)9-10-27(21)14-22(28)26-23-19(12-17(24)13-20(23)25)15-5-3-2-4-6-15/h2-13H,14H2,1H3,(H,26,28)
InChIKeyPTCXCFDEDUIXOR-UHFFFAOYSA-N
XLogP5.23
TPSA43.26 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500392.41
LogP ≤ 55.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(5-methoxyindol-1-yl)-N-pyridin-2-ylacetamide
CID 29137208
(2S)-2-[[2-(5-methoxyindol-1-yl)acetyl]amino]propanoic acid
CID 39377928
2-(5-methoxyindol-1-yl)-N-(3,4,5-trimethoxyphenyl)acetamide
CID 29133435
N-tert-butyl-2-(5-methoxyindol-1-yl)acetamide
CID 115582184
N-(2-hydroxy-2-phenylpropyl)-2-(5-methoxyindol-1-yl)acetamide
CID 111335212
N-(5-chloro-2-pyridinyl)-2-(5-methoxyindol-1-yl)acetamide
CID 29131192
N-(3,5-difluoro-4-methoxyphenyl)-2-indol-1-ylacetamide
CID 87042646
methyl 4-[[2-(5-methoxyindol-1-yl)acetyl]amino]benzoate
CID 29135985
2-(5-methoxyindol-1-yl)-N-prop-2-ynylacetamide
CID 115582181
N-(5-bromo-2-pyridinyl)-2-(5-methoxyindol-1-yl)acetamide
CID 29139061
2-(5-methoxyindol-1-yl)-1-(2-methylphenyl)ethanone
CID 62025582
5-[[2-(5-methoxyindol-1-yl)acetyl]amino]-3,6-dimethylpyridine-2-carboxylic acid
CID 167985231

Frequently Asked Questions

What is the IUPAC name of N-(2,4-difluoro-6-phenylphenyl)-2-(5-methoxyindol-1-yl)acetamide?
The IUPAC name of N-(2,4-difluoro-6-phenylphenyl)-2-(5-methoxyindol-1-yl)acetamide (CID 86843668) is N-(2,4-difluoro-6-phenylphenyl)-2-(5-methoxyindol-1-yl)acetamide.
What is the SMILES notation for N-(2,4-difluoro-6-phenylphenyl)-2-(5-methoxyindol-1-yl)acetamide?
The canonical SMILES for N-(2,4-difluoro-6-phenylphenyl)-2-(5-methoxyindol-1-yl)acetamide is COc1ccc2c(ccn2CC(=O)Nc2c(F)cc(F)cc2-c2ccccc2)c1.
What is the InChIKey of N-(2,4-difluoro-6-phenylphenyl)-2-(5-methoxyindol-1-yl)acetamide?
The InChIKey is PTCXCFDEDUIXOR-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H18F2N2O2/c1-29-18-7-8-21-16(11-18)9-10-27(21)14-22(28)26-23-19(12-17(24)13-20(23)25)15-5-3-2-4-6-15/h2-13H,14H2,1H3,(H,26,28).
What are the key properties of N-(2,4-difluoro-6-phenylphenyl)-2-(5-methoxyindol-1-yl)acetamide?
N-(2,4-difluoro-6-phenylphenyl)-2-(5-methoxyindol-1-yl)acetamide has a molecular weight of 392.41 g/mol, XLogP of 5.23, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,4-difluoro-6-phenylphenyl)-2-(5-methoxyindol-1-yl)acetamide is sourced from PubChem (CID 86843668), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).