N-(2,3-dimethoxyphenyl)-2-(5-fluoro-1H-indol-3-yl)-2-oxoacetamide

C18H15FN2O4 — CID 16764740

IUPACN-(2,3-dimethoxyphenyl)-2-(5-fluoro-1H-indol-3-yl)-2-oxoacetamide
SMILESCOc1cccc(NC(=O)C(=O)c2c[nH]c3ccc(F)cc23)c1OC
InChIInChI=1S/C18H15FN2O4/c1-24-15-5-3-4-14(17(15)25-2)21-18(23)16(22)12-9-20-13-7-6-10(19)8-11(12)13/h3-9,20H,1-2H3,(H,21,23)
InChIKeyRAQFMQMATVAIDX-UHFFFAOYSA-N
MW342.33 g/mol
LogP3.15
Rot. Bonds5

About N-(2,3-dimethoxyphenyl)-2-(5-fluoro-1H-indol-3-yl)-2-oxoacetamide

N-(2,3-dimethoxyphenyl)-2-(5-fluoro-1H-indol-3-yl)-2-oxoacetamide (PubChem CID 16764740) has the molecular formula C18H15FN2O4 and a molecular weight of 342.33 g/mol. Its IUPAC name is N-(2,3-dimethoxyphenyl)-2-(5-fluoro-1H-indol-3-yl)-2-oxoacetamide.

Molecular Properties

Compound NameN-(2,3-dimethoxyphenyl)-2-(5-fluoro-1H-indol-3-yl)-2-oxoacetamide
PubChem CID16764740
Molecular FormulaC18H15FN2O4
Molecular Weight342.33 g/mol
Exact Mass342.10
IUPAC NameN-(2,3-dimethoxyphenyl)-2-(5-fluoro-1H-indol-3-yl)-2-oxoacetamide
SMILESCOc1cccc(NC(=O)C(=O)c2c[nH]c3ccc(F)cc23)c1OC
InChIInChI=1S/C18H15FN2O4/c1-24-15-5-3-4-14(17(15)25-2)21-18(23)16(22)12-9-20-13-7-6-10(19)8-11(12)13/h3-9,20H,1-2H3,(H,21,23)
InChIKeyRAQFMQMATVAIDX-UHFFFAOYSA-N
XLogP3.15
TPSA80.42 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500342.33
LogP ≤ 53.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

N-(4-chloro-2,5-dimethoxyphenyl)-2-(5-fluoro-1H-indol-3-yl)-2-oxoacetamide
CID 113208188
2-(5-fluoro-1H-indol-3-yl)-2-oxo-N-quinolin-8-ylacetamide
CID 113208175
2-(6-fluoro-1H-indol-3-yl)-N-(2-methoxy-5-methylphenyl)-2-oxoacetamide
CID 113208672
2-(5-fluoro-1H-indol-3-yl)-2-oxo-N-phenylacetamide
CID 113208101
5-fluoro-N-(3,4,5-trimethoxyphenyl)-1H-indole-3-carboxamide
CID 113205749
methyl 5-fluoro-1H-indole-3-carboxylate
CID 34176452
N-(2-tert-butylphenyl)-2-(6-fluoro-1H-indol-3-yl)-2-oxoacetamide
CID 113208652
2-(5-methoxy-1H-indol-3-yl)-N-(2-methylphenyl)-2-oxoacetamide
CID 113208438
2-(6-fluoro-1H-indol-3-yl)-2-oxo-N-quinolin-8-ylacetamide
CID 113208706
N-(2-ethylphenyl)-2-(5-methoxy-1H-indol-3-yl)-2-oxoacetamide
CID 113208450
N-cyclopentyl-2-(5-fluoro-1H-indol-3-yl)-2-oxoacetamide
CID 113208021
N-(3-bromo-4-methylphenyl)-2-(5-fluoro-1H-indol-3-yl)-2-oxoacetamide
CID 113208138

Frequently Asked Questions

What is the IUPAC name of N-(2,3-dimethoxyphenyl)-2-(5-fluoro-1H-indol-3-yl)-2-oxoacetamide?
The IUPAC name of N-(2,3-dimethoxyphenyl)-2-(5-fluoro-1H-indol-3-yl)-2-oxoacetamide (CID 16764740) is N-(2,3-dimethoxyphenyl)-2-(5-fluoro-1H-indol-3-yl)-2-oxoacetamide.
What is the SMILES notation for N-(2,3-dimethoxyphenyl)-2-(5-fluoro-1H-indol-3-yl)-2-oxoacetamide?
The canonical SMILES for N-(2,3-dimethoxyphenyl)-2-(5-fluoro-1H-indol-3-yl)-2-oxoacetamide is COc1cccc(NC(=O)C(=O)c2c[nH]c3ccc(F)cc23)c1OC.
What is the InChIKey of N-(2,3-dimethoxyphenyl)-2-(5-fluoro-1H-indol-3-yl)-2-oxoacetamide?
The InChIKey is RAQFMQMATVAIDX-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H15FN2O4/c1-24-15-5-3-4-14(17(15)25-2)21-18(23)16(22)12-9-20-13-7-6-10(19)8-11(12)13/h3-9,20H,1-2H3,(H,21,23).
What are the key properties of N-(2,3-dimethoxyphenyl)-2-(5-fluoro-1H-indol-3-yl)-2-oxoacetamide?
N-(2,3-dimethoxyphenyl)-2-(5-fluoro-1H-indol-3-yl)-2-oxoacetamide has a molecular weight of 342.33 g/mol, XLogP of 3.15, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,3-dimethoxyphenyl)-2-(5-fluoro-1H-indol-3-yl)-2-oxoacetamide is sourced from PubChem (CID 16764740), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).