2-(3-chloro-5-fluorophenyl)-1-[5-(furan-2-yl)-2,3-dihydroindol-1-yl]ethanone

C20H15ClFNO2 — CID 71015470

IUPAC2-(3-chloro-5-fluorophenyl)-1-[5-(furan-2-yl)-2,3-dihydroindol-1-yl]ethanone
SMILESO=C(Cc1cc(F)cc(Cl)c1)N1CCc2cc(-c3ccco3)ccc21
InChIInChI=1S/C20H15ClFNO2/c21-16-8-13(9-17(22)12-16)10-20(24)23-6-5-14-11-15(3-4-18(14)23)19-2-1-7-25-19/h1-4,7-9,11-12H,5-6,10H2
InChIKeyOQQUXYADXPWAKV-UHFFFAOYSA-N
MW355.80 g/mol
LogP4.87
Rot. Bonds3

About 2-(3-chloro-5-fluorophenyl)-1-[5-(furan-2-yl)-2,3-dihydroindol-1-yl]ethanone

2-(3-chloro-5-fluorophenyl)-1-[5-(furan-2-yl)-2,3-dihydroindol-1-yl]ethanone (PubChem CID 71015470) has the molecular formula C20H15ClFNO2 and a molecular weight of 355.80 g/mol. Its IUPAC name is 2-(3-chloro-5-fluorophenyl)-1-[5-(furan-2-yl)-2,3-dihydroindol-1-yl]ethanone.

Molecular Properties

Compound Name2-(3-chloro-5-fluorophenyl)-1-[5-(furan-2-yl)-2,3-dihydroindol-1-yl]ethanone
PubChem CID71015470
Molecular FormulaC20H15ClFNO2
Molecular Weight355.80 g/mol
Exact Mass355.08
IUPAC Name2-(3-chloro-5-fluorophenyl)-1-[5-(furan-2-yl)-2,3-dihydroindol-1-yl]ethanone
SMILESO=C(Cc1cc(F)cc(Cl)c1)N1CCc2cc(-c3ccco3)ccc21
InChIInChI=1S/C20H15ClFNO2/c21-16-8-13(9-17(22)12-16)10-20(24)23-6-5-14-11-15(3-4-18(14)23)19-2-1-7-25-19/h1-4,7-9,11-12H,5-6,10H2
InChIKeyOQQUXYADXPWAKV-UHFFFAOYSA-N
XLogP4.87
TPSA33.45 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500355.80
LogP ≤ 54.87
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2-(3-fluorophenyl)-1-[5-(1-methylpyrazol-3-yl)-2,3-dihydroindol-1-yl]ethanone
CID 71015740
1-[5-(4-amino-7-methylpyrrolo[2,3-d]pyrimidin-5-yl)-2,3-dihydroindol-1-yl]-2-(3,5-dichlorophenyl)ethanone
CID 66823605
2-(2,6-dichlorophenyl)-1-(5-nitro-2,3-dihydroindol-1-yl)ethanone
CID 18102372
1-[5-(4-aminofuran-3-yl)-2,3-dihydroindol-1-yl]-2-(2,5-difluorophenyl)ethanone
CID 141312646
3-(3-fluorophenyl)-1-[4-(1-propanoyl-2,3-dihydroindol-5-yl)phenyl]propan-1-one
CID 167657587
1-[5-[(3,5-dichlorophenyl)sulfanylamino]-2,3-dihydroindol-1-yl]-2-phenylethanone
CID 89244567
1-(5-methoxy-2,3-dihydroindol-1-yl)-2-(4-methylphenyl)ethanone
CID 110714096
2-(5-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)-1-(2,3-dihydroindol-1-yl)ethanone
CID 51277451
2-(2,3-difluorophenyl)-1-[5-(1-methylpyrazol-3-yl)-2,3-dihydroindol-1-yl]ethanone
CID 71015320
2-(3,4-difluorophenyl)-1-(6-fluoro-2,3-dihydroindol-1-yl)ethanone
CID 136513866
1-(5-chloro-2,3-dihydroindol-1-yl)-2-(3-fluorophenoxy)ethanone
CID 110714186
1-(2,3-dihydroindol-1-yl)-2-[3-[3-(furan-2-yl)-1,2,4-oxadiazol-5-yl]azetidin-1-yl]ethanone
CID 90509084

Frequently Asked Questions

What is the IUPAC name of 2-(3-chloro-5-fluorophenyl)-1-[5-(furan-2-yl)-2,3-dihydroindol-1-yl]ethanone?
The IUPAC name of 2-(3-chloro-5-fluorophenyl)-1-[5-(furan-2-yl)-2,3-dihydroindol-1-yl]ethanone (CID 71015470) is 2-(3-chloro-5-fluorophenyl)-1-[5-(furan-2-yl)-2,3-dihydroindol-1-yl]ethanone.
What is the SMILES notation for 2-(3-chloro-5-fluorophenyl)-1-[5-(furan-2-yl)-2,3-dihydroindol-1-yl]ethanone?
The canonical SMILES for 2-(3-chloro-5-fluorophenyl)-1-[5-(furan-2-yl)-2,3-dihydroindol-1-yl]ethanone is O=C(Cc1cc(F)cc(Cl)c1)N1CCc2cc(-c3ccco3)ccc21.
What is the InChIKey of 2-(3-chloro-5-fluorophenyl)-1-[5-(furan-2-yl)-2,3-dihydroindol-1-yl]ethanone?
The InChIKey is OQQUXYADXPWAKV-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H15ClFNO2/c21-16-8-13(9-17(22)12-16)10-20(24)23-6-5-14-11-15(3-4-18(14)23)19-2-1-7-25-19/h1-4,7-9,11-12H,5-6,10H2.
What are the key properties of 2-(3-chloro-5-fluorophenyl)-1-[5-(furan-2-yl)-2,3-dihydroindol-1-yl]ethanone?
2-(3-chloro-5-fluorophenyl)-1-[5-(furan-2-yl)-2,3-dihydroindol-1-yl]ethanone has a molecular weight of 355.80 g/mol, XLogP of 4.87, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-chloro-5-fluorophenyl)-1-[5-(furan-2-yl)-2,3-dihydroindol-1-yl]ethanone is sourced from PubChem (CID 71015470), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).