(2R)-2-(2-bromo-4-chlorophenoxy)-1-morpholin-4-yl-2-phenylethanone

C18H17BrClNO3 — CID 7706069

IUPAC(2R)-2-(2-bromo-4-chlorophenoxy)-1-morpholin-4-yl-2-phenylethanone
SMILESO=C([C@H](Oc1ccc(Cl)cc1Br)c1ccccc1)N1CCOCC1
InChIInChI=1S/C18H17BrClNO3/c19-15-12-14(20)6-7-16(15)24-17(13-4-2-1-3-5-13)18(22)21-8-10-23-11-9-21/h1-7,12,17H,8-11H2/t17-/m1/s1
InChIKeyBFDLIUHXYZSQMA-QGZVFWFLSA-N
MW410.70 g/mol
LogP4.08
Rot. Bonds4

About (2R)-2-(2-bromo-4-chlorophenoxy)-1-morpholin-4-yl-2-phenylethanone

(2R)-2-(2-bromo-4-chlorophenoxy)-1-morpholin-4-yl-2-phenylethanone (PubChem CID 7706069) has the molecular formula C18H17BrClNO3 and a molecular weight of 410.70 g/mol. Its IUPAC name is (2R)-2-(2-bromo-4-chlorophenoxy)-1-morpholin-4-yl-2-phenylethanone.

Molecular Properties

Compound Name(2R)-2-(2-bromo-4-chlorophenoxy)-1-morpholin-4-yl-2-phenylethanone
PubChem CID7706069
Molecular FormulaC18H17BrClNO3
Molecular Weight410.70 g/mol
Exact Mass409.01
IUPAC Name(2R)-2-(2-bromo-4-chlorophenoxy)-1-morpholin-4-yl-2-phenylethanone
SMILESO=C([C@H](Oc1ccc(Cl)cc1Br)c1ccccc1)N1CCOCC1
InChIInChI=1S/C18H17BrClNO3/c19-15-12-14(20)6-7-16(15)24-17(13-4-2-1-3-5-13)18(22)21-8-10-23-11-9-21/h1-7,12,17H,8-11H2/t17-/m1/s1
InChIKeyBFDLIUHXYZSQMA-QGZVFWFLSA-N
XLogP4.08
TPSA38.77 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500410.70
LogP ≤ 54.08
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze (2R)-2-(2-bromo-4-chlorophenoxy)-1-morpholin-4-yl-2-phenylethanone 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)-1-morpholin-4-yl-2-phenyl-2-(2,4,5-trichlorophenoxy)ethanone
CID 7701309
2-(2-bromo-4-chlorophenoxy)-2-phenylacetic acid
CID 22683110
2-(2-methoxy-4-methylphenoxy)-1-morpholin-4-yl-2-phenylethanone
CID 17467186
(2R)-2-(4-bromo-2-chlorophenoxy)-2-phenyl-1-pyrrolidin-1-ylethanone
CID 7700719
1-(4-benzhydrylpiperazin-1-yl)-2-(2-bromo-4-chlorophenoxy)propan-1-one
CID 4981432
(2S)-2-(4-bromo-2-chlorophenoxy)-2-phenyl-1-piperidin-1-ylethanone
CID 7700724
(2R)-2-(4-bromo-2-chlorophenoxy)-2-phenyl-1-piperidin-1-ylethanone
CID 7700726
[(1R)-2-morpholin-4-yl-2-oxo-1-phenylethyl] 2-(4-chlorophenyl)acetate
CID 7699782
4-[(1R)-2-morpholin-4-yl-2-oxo-1-phenylethoxy]benzamide
CID 8639436
(2-morpholin-4-yl-2-oxo-1-phenylethyl) 2,6-dichlorobenzoate
CID 18198853
(2S)-1-morpholin-4-yl-2-[(2-nitro-3-pyridinyl)oxy]-2-phenylethanone
CID 40657737
2-(2-bromo-5-chlorophenyl)-2-chloro-1-morpholin-4-ylethanone
CID 66159358

Frequently Asked Questions

What is the IUPAC name of (2R)-2-(2-bromo-4-chlorophenoxy)-1-morpholin-4-yl-2-phenylethanone?
The IUPAC name of (2R)-2-(2-bromo-4-chlorophenoxy)-1-morpholin-4-yl-2-phenylethanone (CID 7706069) is (2R)-2-(2-bromo-4-chlorophenoxy)-1-morpholin-4-yl-2-phenylethanone.
What is the SMILES notation for (2R)-2-(2-bromo-4-chlorophenoxy)-1-morpholin-4-yl-2-phenylethanone?
The canonical SMILES for (2R)-2-(2-bromo-4-chlorophenoxy)-1-morpholin-4-yl-2-phenylethanone is O=C([C@H](Oc1ccc(Cl)cc1Br)c1ccccc1)N1CCOCC1.
What is the InChIKey of (2R)-2-(2-bromo-4-chlorophenoxy)-1-morpholin-4-yl-2-phenylethanone?
The InChIKey is BFDLIUHXYZSQMA-QGZVFWFLSA-N. The full InChI is InChI=1S/C18H17BrClNO3/c19-15-12-14(20)6-7-16(15)24-17(13-4-2-1-3-5-13)18(22)21-8-10-23-11-9-21/h1-7,12,17H,8-11H2/t17-/m1/s1.
What are the key properties of (2R)-2-(2-bromo-4-chlorophenoxy)-1-morpholin-4-yl-2-phenylethanone?
(2R)-2-(2-bromo-4-chlorophenoxy)-1-morpholin-4-yl-2-phenylethanone has a molecular weight of 410.70 g/mol, XLogP of 4.08, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-(2-bromo-4-chlorophenoxy)-1-morpholin-4-yl-2-phenylethanone is sourced from PubChem (CID 7706069), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).