morpholin-4-yl-[4-[(2S)-4-[(1R)-1-phenylethyl]morpholin-2-yl]phenyl]methanone

C23H28N2O3 — CID 66594396

IUPACmorpholin-4-yl-[4-[(2S)-4-[(1R)-1-phenylethyl]morpholin-2-yl]phenyl]methanone
SMILESC[C@H](c1ccccc1)N1CCO[C@@H](c2ccc(C(=O)N3CCOCC3)cc2)C1
InChIInChI=1S/C23H28N2O3/c1-18(19-5-3-2-4-6-19)25-13-16-28-22(17-25)20-7-9-21(10-8-20)23(26)24-11-14-27-15-12-24/h2-10,18,22H,11-17H2,1H3/t18-,22-/m1/s1
InChIKeyQRDSQUOSDVFJEN-XMSQKQJNSA-N
MW380.49 g/mol
LogP3.29
Rot. Bonds4

About morpholin-4-yl-[4-[(2S)-4-[(1R)-1-phenylethyl]morpholin-2-yl]phenyl]methanone

morpholin-4-yl-[4-[(2S)-4-[(1R)-1-phenylethyl]morpholin-2-yl]phenyl]methanone (PubChem CID 66594396) has the molecular formula C23H28N2O3 and a molecular weight of 380.49 g/mol. Its IUPAC name is morpholin-4-yl-[4-[(2S)-4-[(1R)-1-phenylethyl]morpholin-2-yl]phenyl]methanone.

Molecular Properties

Compound Namemorpholin-4-yl-[4-[(2S)-4-[(1R)-1-phenylethyl]morpholin-2-yl]phenyl]methanone
PubChem CID66594396
Molecular FormulaC23H28N2O3
Molecular Weight380.49 g/mol
Exact Mass380.21
IUPAC Namemorpholin-4-yl-[4-[(2S)-4-[(1R)-1-phenylethyl]morpholin-2-yl]phenyl]methanone
SMILESC[C@H](c1ccccc1)N1CCO[C@@H](c2ccc(C(=O)N3CCOCC3)cc2)C1
InChIInChI=1S/C23H28N2O3/c1-18(19-5-3-2-4-6-19)25-13-16-28-22(17-25)20-7-9-21(10-8-20)23(26)24-11-14-27-15-12-24/h2-10,18,22H,11-17H2,1H3/t18-,22-/m1/s1
InChIKeyQRDSQUOSDVFJEN-XMSQKQJNSA-N
XLogP3.29
TPSA42.01 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500380.49
LogP ≤ 53.29
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze morpholin-4-yl-[4-[(2S)-4-[(1R)-1-phenylethyl]morpholin-2-yl]phenyl]methanone with MolForge

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Related Compounds

N'-hydroxy-4-[(2S)-4-[(1R)-1-phenylethyl]morpholin-2-yl]benzenecarboximidamide
CID 91313579
(2S)-2-(4-fluorophenyl)-4-[(1R)-1-phenylethyl]morpholine
CID 67352997
(2-phenylmorpholin-4-yl)-(4-propan-2-ylphenyl)methanone
CID 84510718
2-[4-[(2S)-4-[(1R)-1-phenylethyl]morpholin-2-yl]anilino]acetamide
CID 66703979
phenyl-[(2R)-4-[(1S)-1-phenylethyl]morpholin-2-yl]methanone
CID 71094651
(2R)-2-(3-fluorophenyl)-4-[(1S)-1-phenylethyl]morpholine
CID 67352838
[4-(4-methylpiperazin-1-yl)phenyl]-(2-phenylmorpholin-4-yl)methanone
CID 131903363
morpholin-4-yl-(2-phenylmorpholin-4-yl)methanone
CID 110291317
[2-[4-(dimethylamino)phenyl]morpholin-4-yl]-(4-propan-2-ylphenyl)methanone
CID 110364195
7,16-bis[(1R)-1-phenylethyl]-1,4,10,13-tetraoxa-7,16-diazacyclooctadecane
CID 12990897
4-(1-phenylethyl)morpholine;hydrochloride
CID 3057369
4-[(2S)-4-acetylmorpholin-2-yl]benzoic acid
CID 167741837

Frequently Asked Questions

What is the IUPAC name of morpholin-4-yl-[4-[(2S)-4-[(1R)-1-phenylethyl]morpholin-2-yl]phenyl]methanone?
The IUPAC name of morpholin-4-yl-[4-[(2S)-4-[(1R)-1-phenylethyl]morpholin-2-yl]phenyl]methanone (CID 66594396) is morpholin-4-yl-[4-[(2S)-4-[(1R)-1-phenylethyl]morpholin-2-yl]phenyl]methanone.
What is the SMILES notation for morpholin-4-yl-[4-[(2S)-4-[(1R)-1-phenylethyl]morpholin-2-yl]phenyl]methanone?
The canonical SMILES for morpholin-4-yl-[4-[(2S)-4-[(1R)-1-phenylethyl]morpholin-2-yl]phenyl]methanone is C[C@H](c1ccccc1)N1CCO[C@@H](c2ccc(C(=O)N3CCOCC3)cc2)C1.
What is the InChIKey of morpholin-4-yl-[4-[(2S)-4-[(1R)-1-phenylethyl]morpholin-2-yl]phenyl]methanone?
The InChIKey is QRDSQUOSDVFJEN-XMSQKQJNSA-N. The full InChI is InChI=1S/C23H28N2O3/c1-18(19-5-3-2-4-6-19)25-13-16-28-22(17-25)20-7-9-21(10-8-20)23(26)24-11-14-27-15-12-24/h2-10,18,22H,11-17H2,1H3/t18-,22-/m1/s1.
What are the key properties of morpholin-4-yl-[4-[(2S)-4-[(1R)-1-phenylethyl]morpholin-2-yl]phenyl]methanone?
morpholin-4-yl-[4-[(2S)-4-[(1R)-1-phenylethyl]morpholin-2-yl]phenyl]methanone has a molecular weight of 380.49 g/mol, XLogP of 3.29, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for morpholin-4-yl-[4-[(2S)-4-[(1R)-1-phenylethyl]morpholin-2-yl]phenyl]methanone is sourced from PubChem (CID 66594396), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).