N-(2-fluorophenyl)-2-(1H-indol-3-yl)-2-oxoacetamide

C16H11FN2O2 — CID 2986288

IUPACN-(2-fluorophenyl)-2-(1H-indol-3-yl)-2-oxoacetamide
SMILESO=C(Nc1ccccc1F)C(=O)c1c[nH]c2ccccc12
InChIInChI=1S/C16H11FN2O2/c17-12-6-2-4-8-14(12)19-16(21)15(20)11-9-18-13-7-3-1-5-10(11)13/h1-9,18H,(H,19,21)
InChIKeyCCSIMYQQPKDQOG-UHFFFAOYSA-N
MW282.27 g/mol
LogP3.13
Rot. Bonds3

About N-(2-fluorophenyl)-2-(1H-indol-3-yl)-2-oxoacetamide

N-(2-fluorophenyl)-2-(1H-indol-3-yl)-2-oxoacetamide (PubChem CID 2986288) has the molecular formula C16H11FN2O2 and a molecular weight of 282.27 g/mol. Its IUPAC name is N-(2-fluorophenyl)-2-(1H-indol-3-yl)-2-oxoacetamide.

Molecular Properties

Compound NameN-(2-fluorophenyl)-2-(1H-indol-3-yl)-2-oxoacetamide
PubChem CID2986288
Molecular FormulaC16H11FN2O2
Molecular Weight282.27 g/mol
Exact Mass282.08
IUPAC NameN-(2-fluorophenyl)-2-(1H-indol-3-yl)-2-oxoacetamide
SMILESO=C(Nc1ccccc1F)C(=O)c1c[nH]c2ccccc12
InChIInChI=1S/C16H11FN2O2/c17-12-6-2-4-8-14(12)19-16(21)15(20)11-9-18-13-7-3-1-5-10(11)13/h1-9,18H,(H,19,21)
InChIKeyCCSIMYQQPKDQOG-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

N-cyclopropyl-2-[[2-(1H-indol-3-yl)-2-oxoacetyl]amino]benzamide
CID 38112267
(2,3-difluorophenyl)-(1H-indol-3-yl)methanone
CID 62648503
2-(1H-indol-3-yl)-2-oxo-N-[2-(piperidin-1-ylmethyl)phenyl]acetamide
CID 59008542
N-(2-tert-butylphenyl)-2-(6-fluoro-1H-indol-3-yl)-2-oxoacetamide
CID 113208652
N-(2-hydroxyphenyl)-1H-indole-3-carboxamide
CID 57210773
N-(4-cyanophenyl)-2-(1H-indol-3-yl)-2-oxoacetamide
CID 27161298
ethyl 2-[[2-(6-chloro-1H-indol-3-yl)-2-oxoacetyl]amino]benzoate
CID 113208895
2-(2-fluorophenyl)-1-(1H-indol-3-yl)ethanone
CID 43339237
N-(5-acetamido-2-methoxyphenyl)-2-(1H-indol-3-yl)-2-oxoacetamide
CID 7117383
N-(2-bromo-6-fluorophenyl)-1H-indole-3-carboxamide
CID 107602604
2-(5-fluoro-1H-indol-3-yl)-2-oxo-N-phenylacetamide
CID 113208101
N-(2-cyanopropan-2-yl)-2-(1H-indol-3-yl)-2-oxoacetamide
CID 4618284

Frequently Asked Questions

What is the IUPAC name of N-(2-fluorophenyl)-2-(1H-indol-3-yl)-2-oxoacetamide?
The IUPAC name of N-(2-fluorophenyl)-2-(1H-indol-3-yl)-2-oxoacetamide (CID 2986288) is N-(2-fluorophenyl)-2-(1H-indol-3-yl)-2-oxoacetamide.
What is the SMILES notation for N-(2-fluorophenyl)-2-(1H-indol-3-yl)-2-oxoacetamide?
The canonical SMILES for N-(2-fluorophenyl)-2-(1H-indol-3-yl)-2-oxoacetamide is O=C(Nc1ccccc1F)C(=O)c1c[nH]c2ccccc12.
What is the InChIKey of N-(2-fluorophenyl)-2-(1H-indol-3-yl)-2-oxoacetamide?
The InChIKey is CCSIMYQQPKDQOG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H11FN2O2/c17-12-6-2-4-8-14(12)19-16(21)15(20)11-9-18-13-7-3-1-5-10(11)13/h1-9,18H,(H,19,21).
What are the key properties of N-(2-fluorophenyl)-2-(1H-indol-3-yl)-2-oxoacetamide?
N-(2-fluorophenyl)-2-(1H-indol-3-yl)-2-oxoacetamide 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 N-(2-fluorophenyl)-2-(1H-indol-3-yl)-2-oxoacetamide is sourced from PubChem (CID 2986288), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).