(2,5-dichlorophenyl)-(2,3-dihydroindol-1-yl)methanone

C15H11Cl2NO — CID 783595

IUPAC(2,5-dichlorophenyl)-(2,3-dihydroindol-1-yl)methanone
SMILESO=C(c1cc(Cl)ccc1Cl)N1CCc2ccccc21
InChIInChI=1S/C15H11Cl2NO/c16-11-5-6-13(17)12(9-11)15(19)18-8-7-10-3-1-2-4-14(10)18/h1-6,9H,7-8H2
InChIKeyPNCFNINZVBGBST-UHFFFAOYSA-N
MW292.17 g/mol
LogP4.20
Rot. Bonds1

About (2,5-dichlorophenyl)-(2,3-dihydroindol-1-yl)methanone

(2,5-dichlorophenyl)-(2,3-dihydroindol-1-yl)methanone (PubChem CID 783595) has the molecular formula C15H11Cl2NO and a molecular weight of 292.17 g/mol. Its IUPAC name is (2,5-dichlorophenyl)-(2,3-dihydroindol-1-yl)methanone.

Molecular Properties

Compound Name(2,5-dichlorophenyl)-(2,3-dihydroindol-1-yl)methanone
PubChem CID783595
Molecular FormulaC15H11Cl2NO
Molecular Weight292.17 g/mol
Exact Mass291.02
IUPAC Name(2,5-dichlorophenyl)-(2,3-dihydroindol-1-yl)methanone
SMILESO=C(c1cc(Cl)ccc1Cl)N1CCc2ccccc21
InChIInChI=1S/C15H11Cl2NO/c16-11-5-6-13(17)12(9-11)15(19)18-8-7-10-3-1-2-4-14(10)18/h1-6,9H,7-8H2
InChIKeyPNCFNINZVBGBST-UHFFFAOYSA-N
XLogP4.20
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.17
LogP ≤ 54.20
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

1-(4-Chlorobenzyl)-1H-indole-2,3-dione
CID 277990
2-Chloro-N-methyl-N-phenylbenzamide
CID 587357
1-(3,4-dichlorobenzyl)-1H-indole-2,3-dione
CID 1901244
2-(4-Chlorophenyl)-1,2-benzisoselenazol-3(2H)-one
CID 368648
5-chloro-2-[4-(dimethylamino)phenyl]-3H-isoindol-1-one
CID 25266663
6-chloro-2-[4-(dimethylamino)phenyl]-3H-isoindol-1-one
CID 25266667
2,3-Dihydroindol-1-yl-(2-fluorophenyl)methanone
CID 579820
1-benzoyl-2,3-dihydro-1H-indole
CID 681214
1-Butyl-5-chloroindoline-2,3-dione
CID 4736862
(3Z)-3-(2-chlorobenzylidene)-1,3-dihydro-2H-indol-2-one
CID 727521
2-chloro-N-ethyl-N-phenylbenzamide
CID 722355
(2,4-Dichloro-phenyl)-(2,3-dihydro-indol-1-yl)-methanone
CID 819675

Frequently Asked Questions

What is the IUPAC name of (2,5-dichlorophenyl)-(2,3-dihydroindol-1-yl)methanone?
The IUPAC name of (2,5-dichlorophenyl)-(2,3-dihydroindol-1-yl)methanone (CID 783595) is (2,5-dichlorophenyl)-(2,3-dihydroindol-1-yl)methanone.
What is the SMILES notation for (2,5-dichlorophenyl)-(2,3-dihydroindol-1-yl)methanone?
The canonical SMILES for (2,5-dichlorophenyl)-(2,3-dihydroindol-1-yl)methanone is O=C(c1cc(Cl)ccc1Cl)N1CCc2ccccc21.
What is the InChIKey of (2,5-dichlorophenyl)-(2,3-dihydroindol-1-yl)methanone?
The InChIKey is PNCFNINZVBGBST-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11Cl2NO/c16-11-5-6-13(17)12(9-11)15(19)18-8-7-10-3-1-2-4-14(10)18/h1-6,9H,7-8H2.
What are the key properties of (2,5-dichlorophenyl)-(2,3-dihydroindol-1-yl)methanone?
(2,5-dichlorophenyl)-(2,3-dihydroindol-1-yl)methanone has a molecular weight of 292.17 g/mol, XLogP of 4.20, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2,5-dichlorophenyl)-(2,3-dihydroindol-1-yl)methanone is sourced from PubChem (CID 783595), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).