4-chloro-N-[2-(2-oxo-1,3-dihydroindol-3-yl)ethyl]benzamide

C17H15ClN2O2 — CID 110730209

IUPAC4-chloro-N-[2-(2-oxo-1,3-dihydroindol-3-yl)ethyl]benzamide
SMILESO=C(NCCC1C(=O)Nc2ccccc21)c1ccc(Cl)cc1
InChIInChI=1S/C17H15ClN2O2/c18-12-7-5-11(6-8-12)16(21)19-10-9-14-13-3-1-2-4-15(13)20-17(14)22/h1-8,14H,9-10H2,(H,19,21)(H,20,22)
InChIKeyFQUYQWWOTQRWRG-UHFFFAOYSA-N
MW314.77 g/mol
LogP3.20
Rot. Bonds4

About 4-chloro-N-[2-(2-oxo-1,3-dihydroindol-3-yl)ethyl]benzamide

4-chloro-N-[2-(2-oxo-1,3-dihydroindol-3-yl)ethyl]benzamide (PubChem CID 110730209) has the molecular formula C17H15ClN2O2 and a molecular weight of 314.77 g/mol. Its IUPAC name is 4-chloro-N-[2-(2-oxo-1,3-dihydroindol-3-yl)ethyl]benzamide.

Molecular Properties

Compound Name4-chloro-N-[2-(2-oxo-1,3-dihydroindol-3-yl)ethyl]benzamide
PubChem CID110730209
Molecular FormulaC17H15ClN2O2
Molecular Weight314.77 g/mol
Exact Mass314.08
IUPAC Name4-chloro-N-[2-(2-oxo-1,3-dihydroindol-3-yl)ethyl]benzamide
SMILESO=C(NCCC1C(=O)Nc2ccccc21)c1ccc(Cl)cc1
InChIInChI=1S/C17H15ClN2O2/c18-12-7-5-11(6-8-12)16(21)19-10-9-14-13-3-1-2-4-15(13)20-17(14)22/h1-8,14H,9-10H2,(H,19,21)(H,20,22)
InChIKeyFQUYQWWOTQRWRG-UHFFFAOYSA-N
XLogP3.20
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500314.77
LogP ≤ 53.20
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

1-(4-chlorophenyl)-3-[2-(2-oxo-1,3-dihydroindol-3-yl)ethyl]urea
CID 110748774
3,5-dimethoxy-N-[2-(2-oxo-1,3-dihydroindol-3-yl)ethyl]benzamide
CID 110730193
2-methoxy-N-[2-(2-oxo-1,3-dihydroindol-3-yl)ethyl]benzamide
CID 110730190
1-[2-[(3S)-2-oxo-1,3-dihydroindol-3-yl]ethyl]-3-phenylurea
CID 31771075
6-methyl-2-oxo-N-[2-[(3S)-2-oxo-1,3-dihydroindol-3-yl]ethyl]-1H-pyridine-3-carboxamide
CID 95150703
N-[2-(2-oxo-1,3-dihydroindol-3-yl)ethyl]cyclohexanecarboxamide
CID 110730173
N-[2-(2-oxo-1,3-dihydroindol-3-yl)ethyl]-2-thiophen-2-ylacetamide
CID 110730198
N-[2-(2-oxo-1,3-dihydroindol-3-yl)ethyl]-2-phenoxyacetamide
CID 110730204
(3S)-3-[2-[(5-chloropyrimidin-2-yl)amino]ethyl]-1,3-dihydroindol-2-one
CID 124888729
1-(2-chloro-5-fluorophenyl)-3-[2-[(3R)-2-oxo-1,3-dihydroindol-3-yl]ethyl]urea
CID 95568579
1-(2-chloro-5-fluorophenyl)-3-[2-[(3S)-2-oxo-1,3-dihydroindol-3-yl]ethyl]urea
CID 98139825
3-(2-oxo-1,3-dihydroindol-3-yl)propanoic acid
CID 589482

Frequently Asked Questions

What is the IUPAC name of 4-chloro-N-[2-(2-oxo-1,3-dihydroindol-3-yl)ethyl]benzamide?
The IUPAC name of 4-chloro-N-[2-(2-oxo-1,3-dihydroindol-3-yl)ethyl]benzamide (CID 110730209) is 4-chloro-N-[2-(2-oxo-1,3-dihydroindol-3-yl)ethyl]benzamide.
What is the SMILES notation for 4-chloro-N-[2-(2-oxo-1,3-dihydroindol-3-yl)ethyl]benzamide?
The canonical SMILES for 4-chloro-N-[2-(2-oxo-1,3-dihydroindol-3-yl)ethyl]benzamide is O=C(NCCC1C(=O)Nc2ccccc21)c1ccc(Cl)cc1.
What is the InChIKey of 4-chloro-N-[2-(2-oxo-1,3-dihydroindol-3-yl)ethyl]benzamide?
The InChIKey is FQUYQWWOTQRWRG-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15ClN2O2/c18-12-7-5-11(6-8-12)16(21)19-10-9-14-13-3-1-2-4-15(13)20-17(14)22/h1-8,14H,9-10H2,(H,19,21)(H,20,22).
What are the key properties of 4-chloro-N-[2-(2-oxo-1,3-dihydroindol-3-yl)ethyl]benzamide?
4-chloro-N-[2-(2-oxo-1,3-dihydroindol-3-yl)ethyl]benzamide has a molecular weight of 314.77 g/mol, XLogP of 3.20, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-N-[2-(2-oxo-1,3-dihydroindol-3-yl)ethyl]benzamide is sourced from PubChem (CID 110730209), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).