(2R)-2-(2-chlorophenoxy)-1-(1H-indol-3-yl)propan-1-one

C17H14ClNO2 — CID 7815825

IUPAC(2R)-2-(2-chlorophenoxy)-1-(1H-indol-3-yl)propan-1-one
SMILESC[C@@H](Oc1ccccc1Cl)C(=O)c1c[nH]c2ccccc12
InChIInChI=1S/C17H14ClNO2/c1-11(21-16-9-5-3-7-14(16)18)17(20)13-10-19-15-8-4-2-6-12(13)15/h2-11,19H,1H3/t11-/m1/s1
InChIKeyFGKREBABCWKWFH-LLVKDONJSA-N
MW299.76 g/mol
LogP4.47
Rot. Bonds4

About (2R)-2-(2-chlorophenoxy)-1-(1H-indol-3-yl)propan-1-one

(2R)-2-(2-chlorophenoxy)-1-(1H-indol-3-yl)propan-1-one (PubChem CID 7815825) has the molecular formula C17H14ClNO2 and a molecular weight of 299.76 g/mol. Its IUPAC name is (2R)-2-(2-chlorophenoxy)-1-(1H-indol-3-yl)propan-1-one.

Molecular Properties

Compound Name(2R)-2-(2-chlorophenoxy)-1-(1H-indol-3-yl)propan-1-one
PubChem CID7815825
Molecular FormulaC17H14ClNO2
Molecular Weight299.76 g/mol
Exact Mass299.07
IUPAC Name(2R)-2-(2-chlorophenoxy)-1-(1H-indol-3-yl)propan-1-one
SMILESC[C@@H](Oc1ccccc1Cl)C(=O)c1c[nH]c2ccccc12
InChIInChI=1S/C17H14ClNO2/c1-11(21-16-9-5-3-7-14(16)18)17(20)13-10-19-15-8-4-2-6-12(13)15/h2-11,19H,1H3/t11-/m1/s1
InChIKeyFGKREBABCWKWFH-LLVKDONJSA-N
XLogP4.47
TPSA42.09 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.76
LogP ≤ 54.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze (2R)-2-(2-chlorophenoxy)-1-(1H-indol-3-yl)propan-1-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(2R)-2-(2-chloro-4-nitrophenoxy)-1-(1H-indol-3-yl)propan-1-one
CID 7865852
(2R)-1-(1H-indol-3-yl)-2-(2-nitrophenoxy)propan-1-one
CID 7819094
[(2S)-1-(1H-indol-3-yl)-1-oxopropan-2-yl] 4-chlorobenzoate
CID 7797163
4-[(2S)-1-(1H-indol-3-yl)-1-oxopropan-2-yl]oxybenzamide
CID 7931301
[(2R)-1-(1H-indol-3-yl)-1-oxopropan-2-yl] 2-(2-chloro-5-methylphenoxy)acetate
CID 7570362
[1-(1H-indol-3-yl)-1-oxopropan-2-yl] benzoate
CID 42984005
[(2R)-1-(1H-indol-3-yl)-1-oxopropan-2-yl] (2S)-2-phenoxypropanoate
CID 8790821
[(2S)-1-(1H-indol-3-yl)-1-oxopropan-2-yl] (1S)-2,2-dichloro-1-methylcyclopropane-1-carboxylate
CID 9454513
[(2S)-1-(1H-indol-3-yl)-1-oxopropan-2-yl] 2-(difluoromethoxy)benzoate
CID 7609192
[1-(1H-indol-3-yl)-1-oxopropan-2-yl] 4-hydroxybenzoate
CID 46790132
[(2R)-1-(1H-indol-3-yl)-1-oxopropan-2-yl] 2-[(S)-methylsulfinyl]benzoate
CID 11927398
[(2R)-1-(1H-indol-3-yl)-1-oxopropan-2-yl] (3R)-3-(carbamoylamino)-3-(2-chlorophenyl)propanoate
CID 7757785

Frequently Asked Questions

What is the IUPAC name of (2R)-2-(2-chlorophenoxy)-1-(1H-indol-3-yl)propan-1-one?
The IUPAC name of (2R)-2-(2-chlorophenoxy)-1-(1H-indol-3-yl)propan-1-one (CID 7815825) is (2R)-2-(2-chlorophenoxy)-1-(1H-indol-3-yl)propan-1-one.
What is the SMILES notation for (2R)-2-(2-chlorophenoxy)-1-(1H-indol-3-yl)propan-1-one?
The canonical SMILES for (2R)-2-(2-chlorophenoxy)-1-(1H-indol-3-yl)propan-1-one is C[C@@H](Oc1ccccc1Cl)C(=O)c1c[nH]c2ccccc12.
What is the InChIKey of (2R)-2-(2-chlorophenoxy)-1-(1H-indol-3-yl)propan-1-one?
The InChIKey is FGKREBABCWKWFH-LLVKDONJSA-N. The full InChI is InChI=1S/C17H14ClNO2/c1-11(21-16-9-5-3-7-14(16)18)17(20)13-10-19-15-8-4-2-6-12(13)15/h2-11,19H,1H3/t11-/m1/s1.
What are the key properties of (2R)-2-(2-chlorophenoxy)-1-(1H-indol-3-yl)propan-1-one?
(2R)-2-(2-chlorophenoxy)-1-(1H-indol-3-yl)propan-1-one has a molecular weight of 299.76 g/mol, XLogP of 4.47, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-(2-chlorophenoxy)-1-(1H-indol-3-yl)propan-1-one is sourced from PubChem (CID 7815825), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).