2-(5-fluoro-1H-indol-3-yl)-2-oxo-N-phenylacetamide

C16H11FN2O2 — CID 113208101

IUPAC2-(5-fluoro-1H-indol-3-yl)-2-oxo-N-phenylacetamide
SMILESO=C(Nc1ccccc1)C(=O)c1c[nH]c2ccc(F)cc12
InChIInChI=1S/C16H11FN2O2/c17-10-6-7-14-12(8-10)13(9-18-14)15(20)16(21)19-11-4-2-1-3-5-11/h1-9,18H,(H,19,21)
InChIKeyFEZRIDUPFYHYQK-UHFFFAOYSA-N
MW282.27 g/mol
LogP3.13
Rot. Bonds3

About 2-(5-fluoro-1H-indol-3-yl)-2-oxo-N-phenylacetamide

2-(5-fluoro-1H-indol-3-yl)-2-oxo-N-phenylacetamide (PubChem CID 113208101) has the molecular formula C16H11FN2O2 and a molecular weight of 282.27 g/mol. Its IUPAC name is 2-(5-fluoro-1H-indol-3-yl)-2-oxo-N-phenylacetamide.

Molecular Properties

Compound Name2-(5-fluoro-1H-indol-3-yl)-2-oxo-N-phenylacetamide
PubChem CID113208101
Molecular FormulaC16H11FN2O2
Molecular Weight282.27 g/mol
Exact Mass282.08
IUPAC Name2-(5-fluoro-1H-indol-3-yl)-2-oxo-N-phenylacetamide
SMILESO=C(Nc1ccccc1)C(=O)c1c[nH]c2ccc(F)cc12
InChIInChI=1S/C16H11FN2O2/c17-10-6-7-14-12(8-10)13(9-18-14)15(20)16(21)19-11-4-2-1-3-5-11/h1-9,18H,(H,19,21)
InChIKeyFEZRIDUPFYHYQK-UHFFFAOYSA-N
XLogP3.13
TPSA61.96 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.27
LogP ≤ 53.13
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'diketo_group', 'substructure': 'N/A'}

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Related Compounds

2-[5-(iodomethyl)-1H-indol-3-yl]-2-oxo-N-phenylacetamide
CID 89369412
N-(3-bromo-4-methylphenyl)-2-(5-fluoro-1H-indol-3-yl)-2-oxoacetamide
CID 113208138
2-(6-chloro-1H-indol-3-yl)-2-oxo-N-phenylacetamide
CID 54771139
N-cyclopropyl-2-(5-fluoro-1H-indol-3-yl)-2-oxoacetamide
CID 113208015
2-(5-fluoro-1H-indol-3-yl)-2-oxo-N-quinolin-8-ylacetamide
CID 113208175
N-(2,3-dimethoxyphenyl)-2-(5-fluoro-1H-indol-3-yl)-2-oxoacetamide
CID 16764740
N-(3,5-dimethylphenyl)-2-(6-fluoro-1H-indol-3-yl)-2-oxoacetamide
CID 113208640
N-cyclopentyl-2-(5-fluoro-1H-indol-3-yl)-2-oxoacetamide
CID 113208021
6-fluoro-N-(4-fluorophenyl)-4-oxo-1H-quinoline-3-carboxamide
CID 39849776
N-(2-tert-butylphenyl)-2-(6-fluoro-1H-indol-3-yl)-2-oxoacetamide
CID 113208652
5-fluoro-1H-indole-3-carbonyl iodide
CID 166942307
N-butyl-2-(5-fluoro-1H-indol-3-yl)-2-oxoacetamide
CID 113208017

Frequently Asked Questions

What is the IUPAC name of 2-(5-fluoro-1H-indol-3-yl)-2-oxo-N-phenylacetamide?
The IUPAC name of 2-(5-fluoro-1H-indol-3-yl)-2-oxo-N-phenylacetamide (CID 113208101) is 2-(5-fluoro-1H-indol-3-yl)-2-oxo-N-phenylacetamide.
What is the SMILES notation for 2-(5-fluoro-1H-indol-3-yl)-2-oxo-N-phenylacetamide?
The canonical SMILES for 2-(5-fluoro-1H-indol-3-yl)-2-oxo-N-phenylacetamide is O=C(Nc1ccccc1)C(=O)c1c[nH]c2ccc(F)cc12.
What is the InChIKey of 2-(5-fluoro-1H-indol-3-yl)-2-oxo-N-phenylacetamide?
The InChIKey is FEZRIDUPFYHYQK-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H11FN2O2/c17-10-6-7-14-12(8-10)13(9-18-14)15(20)16(21)19-11-4-2-1-3-5-11/h1-9,18H,(H,19,21).
What are the key properties of 2-(5-fluoro-1H-indol-3-yl)-2-oxo-N-phenylacetamide?
2-(5-fluoro-1H-indol-3-yl)-2-oxo-N-phenylacetamide has a molecular weight of 282.27 g/mol, XLogP of 3.13, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-fluoro-1H-indol-3-yl)-2-oxo-N-phenylacetamide is sourced from PubChem (CID 113208101), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).