2-(2,3-dihydroindol-1-yl)-N-(3-fluorophenyl)-2-oxoacetamide

C16H13FN2O2 — CID 108531920

IUPAC2-(2,3-dihydroindol-1-yl)-N-(3-fluorophenyl)-2-oxoacetamide
SMILESO=C(Nc1cccc(F)c1)C(=O)N1CCc2ccccc21
InChIInChI=1S/C16H13FN2O2/c17-12-5-3-6-13(10-12)18-15(20)16(21)19-9-8-11-4-1-2-7-14(11)19/h1-7,10H,8-9H2,(H,18,20)
InChIKeyUIBLFQUFNUEBNI-UHFFFAOYSA-N
MW284.29 g/mol
LogP2.35
Rot. Bonds1

About 2-(2,3-dihydroindol-1-yl)-N-(3-fluorophenyl)-2-oxoacetamide

2-(2,3-dihydroindol-1-yl)-N-(3-fluorophenyl)-2-oxoacetamide (PubChem CID 108531920) has the molecular formula C16H13FN2O2 and a molecular weight of 284.29 g/mol. Its IUPAC name is 2-(2,3-dihydroindol-1-yl)-N-(3-fluorophenyl)-2-oxoacetamide.

Molecular Properties

Compound Name2-(2,3-dihydroindol-1-yl)-N-(3-fluorophenyl)-2-oxoacetamide
PubChem CID108531920
Molecular FormulaC16H13FN2O2
Molecular Weight284.29 g/mol
Exact Mass284.10
IUPAC Name2-(2,3-dihydroindol-1-yl)-N-(3-fluorophenyl)-2-oxoacetamide
SMILESO=C(Nc1cccc(F)c1)C(=O)N1CCc2ccccc21
InChIInChI=1S/C16H13FN2O2/c17-12-5-3-6-13(10-12)18-15(20)16(21)19-9-8-11-4-1-2-7-14(11)19/h1-7,10H,8-9H2,(H,18,20)
InChIKeyUIBLFQUFNUEBNI-UHFFFAOYSA-N
XLogP2.35
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.29
LogP ≤ 52.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

2-(2,3-dihydroindol-1-yl)-2-oxo-N-phenylacetamide
CID 108521834
N-(3-chloro-4-fluorophenyl)-2-(2,3-dihydroindol-1-yl)-2-oxoacetamide
CID 108530542
2-(2,3-dihydroindol-1-yl)-N-(3,4-dimethylphenyl)-2-oxoacetamide
CID 108523162
2-(3,4-dihydro-2H-quinolin-1-yl)-N-(3-methylsulfanylphenyl)-2-oxoacetamide
CID 108505619
1-(2,3-dihydroindol-1-yl)-3-(3-fluoroanilino)propan-1-one
CID 109034782
2-(2,3-dihydroindol-1-yl)-N-(4-ethylphenyl)-2-oxoacetamide
CID 108522344
N-(2,4-difluorophenyl)-2-(3,4-dihydro-2H-quinolin-1-yl)-2-oxoacetamide
CID 108505775
2-(3,4-dihydro-2H-quinolin-1-yl)-N-[3-(dimethylamino)phenyl]-2-oxoacetamide
CID 108505690
2-(2,3-dihydroindol-1-yl)-N-(4-methoxyphenyl)-2-oxoacetamide
CID 108502677
4-(3,4-dihydro-2H-quinoline-1-carbonyl)-N-(3-fluorophenyl)cyclohexane-1-carboxamide
CID 109150621
2-(2,3-dihydroindol-1-yl)-N-(5-hydroxynaphthalen-1-yl)-2-oxoacetamide
CID 108509407
N'-(1-acetyl-3,4-dihydro-2H-quinolin-7-yl)-N-(3-fluorophenyl)oxamide
CID 7586378

Frequently Asked Questions

What is the IUPAC name of 2-(2,3-dihydroindol-1-yl)-N-(3-fluorophenyl)-2-oxoacetamide?
The IUPAC name of 2-(2,3-dihydroindol-1-yl)-N-(3-fluorophenyl)-2-oxoacetamide (CID 108531920) is 2-(2,3-dihydroindol-1-yl)-N-(3-fluorophenyl)-2-oxoacetamide.
What is the SMILES notation for 2-(2,3-dihydroindol-1-yl)-N-(3-fluorophenyl)-2-oxoacetamide?
The canonical SMILES for 2-(2,3-dihydroindol-1-yl)-N-(3-fluorophenyl)-2-oxoacetamide is O=C(Nc1cccc(F)c1)C(=O)N1CCc2ccccc21.
What is the InChIKey of 2-(2,3-dihydroindol-1-yl)-N-(3-fluorophenyl)-2-oxoacetamide?
The InChIKey is UIBLFQUFNUEBNI-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H13FN2O2/c17-12-5-3-6-13(10-12)18-15(20)16(21)19-9-8-11-4-1-2-7-14(11)19/h1-7,10H,8-9H2,(H,18,20).
What are the key properties of 2-(2,3-dihydroindol-1-yl)-N-(3-fluorophenyl)-2-oxoacetamide?
2-(2,3-dihydroindol-1-yl)-N-(3-fluorophenyl)-2-oxoacetamide has a molecular weight of 284.29 g/mol, XLogP of 2.35, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,3-dihydroindol-1-yl)-N-(3-fluorophenyl)-2-oxoacetamide is sourced from PubChem (CID 108531920), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).