3-(2-chlorophenyl)-1-[2-(4-chlorophenyl)morpholin-4-yl]propan-1-one

C19H19Cl2NO2 — CID 55947512

IUPAC3-(2-chlorophenyl)-1-[2-(4-chlorophenyl)morpholin-4-yl]propan-1-one
SMILESO=C(CCc1ccccc1Cl)N1CCOC(c2ccc(Cl)cc2)C1
InChIInChI=1S/C19H19Cl2NO2/c20-16-8-5-15(6-9-16)18-13-22(11-12-24-18)19(23)10-7-14-3-1-2-4-17(14)21/h1-6,8-9,18H,7,10-13H2
InChIKeyWAQDLWGEAWXBIQ-UHFFFAOYSA-N
MW364.27 g/mol
LogP4.53
Rot. Bonds4

About 3-(2-chlorophenyl)-1-[2-(4-chlorophenyl)morpholin-4-yl]propan-1-one

3-(2-chlorophenyl)-1-[2-(4-chlorophenyl)morpholin-4-yl]propan-1-one (PubChem CID 55947512) has the molecular formula C19H19Cl2NO2 and a molecular weight of 364.27 g/mol. Its IUPAC name is 3-(2-chlorophenyl)-1-[2-(4-chlorophenyl)morpholin-4-yl]propan-1-one.

Molecular Properties

Compound Name3-(2-chlorophenyl)-1-[2-(4-chlorophenyl)morpholin-4-yl]propan-1-one
PubChem CID55947512
Molecular FormulaC19H19Cl2NO2
Molecular Weight364.27 g/mol
Exact Mass363.08
IUPAC Name3-(2-chlorophenyl)-1-[2-(4-chlorophenyl)morpholin-4-yl]propan-1-one
SMILESO=C(CCc1ccccc1Cl)N1CCOC(c2ccc(Cl)cc2)C1
InChIInChI=1S/C19H19Cl2NO2/c20-16-8-5-15(6-9-16)18-13-22(11-12-24-18)19(23)10-7-14-3-1-2-4-17(14)21/h1-6,8-9,18H,7,10-13H2
InChIKeyWAQDLWGEAWXBIQ-UHFFFAOYSA-N
XLogP4.53
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500364.27
LogP ≤ 54.53
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

1-[2-(4-chlorophenyl)morpholin-4-yl]-2-hydroxyethanone
CID 56878936
1-(4-chlorophenyl)-4-[2-(4-chlorophenyl)morpholin-4-yl]butane-1,4-dione
CID 110356660
5-amino-1-[(2R)-2-(4-chlorophenyl)morpholin-4-yl]pentan-1-one
CID 95358094
3-(2-aminophenyl)-1-[2-(4-fluorophenyl)morpholin-4-yl]propan-1-one
CID 120607548
1-[2-(4-chlorophenyl)morpholin-4-yl]-2-pyrrolidin-1-ylethanone
CID 56741046
1-[(2S)-2-(4-chlorophenyl)morpholin-4-yl]-2-piperidin-1-ylethanone
CID 95197348
1-[2-(4-chlorophenyl)morpholin-4-yl]butane-1,3-dione
CID 60951251
3-amino-1-(2-phenylmorpholin-4-yl)propan-1-one;hydrochloride
CID 119278810
2-anilino-1-[2-(4-chlorophenyl)morpholin-4-yl]ethanone;hydrochloride
CID 119725525
5-amino-1-[2-(4-chlorophenyl)morpholin-4-yl]hexan-1-one
CID 82849703
3-amino-1-[2-(3-chloro-4-fluorophenyl)morpholin-4-yl]propan-1-one;hydrochloride
CID 119315236
1-[(2S)-2-(4-chlorophenyl)morpholin-4-yl]-2-(dimethylamino)ethanone
CID 95205970

Frequently Asked Questions

What is the IUPAC name of 3-(2-chlorophenyl)-1-[2-(4-chlorophenyl)morpholin-4-yl]propan-1-one?
The IUPAC name of 3-(2-chlorophenyl)-1-[2-(4-chlorophenyl)morpholin-4-yl]propan-1-one (CID 55947512) is 3-(2-chlorophenyl)-1-[2-(4-chlorophenyl)morpholin-4-yl]propan-1-one.
What is the SMILES notation for 3-(2-chlorophenyl)-1-[2-(4-chlorophenyl)morpholin-4-yl]propan-1-one?
The canonical SMILES for 3-(2-chlorophenyl)-1-[2-(4-chlorophenyl)morpholin-4-yl]propan-1-one is O=C(CCc1ccccc1Cl)N1CCOC(c2ccc(Cl)cc2)C1.
What is the InChIKey of 3-(2-chlorophenyl)-1-[2-(4-chlorophenyl)morpholin-4-yl]propan-1-one?
The InChIKey is WAQDLWGEAWXBIQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19Cl2NO2/c20-16-8-5-15(6-9-16)18-13-22(11-12-24-18)19(23)10-7-14-3-1-2-4-17(14)21/h1-6,8-9,18H,7,10-13H2.
What are the key properties of 3-(2-chlorophenyl)-1-[2-(4-chlorophenyl)morpholin-4-yl]propan-1-one?
3-(2-chlorophenyl)-1-[2-(4-chlorophenyl)morpholin-4-yl]propan-1-one has a molecular weight of 364.27 g/mol, XLogP of 4.53, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-chlorophenyl)-1-[2-(4-chlorophenyl)morpholin-4-yl]propan-1-one is sourced from PubChem (CID 55947512), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).