(2S,3S)-2-hydroxy-3-morpholin-4-yl-1,3-diphenylpropan-1-one

C19H21NO3 — CID 1481632

IUPAC(2S,3S)-2-hydroxy-3-morpholin-4-yl-1,3-diphenylpropan-1-one
SMILESO=C(c1ccccc1)[C@@H](O)[C@H](c1ccccc1)N1CCOCC1
InChIInChI=1S/C19H21NO3/c21-18(16-9-5-2-6-10-16)19(22)17(15-7-3-1-4-8-15)20-11-13-23-14-12-20/h1-10,17,19,22H,11-14H2/t17-,19-/m0/s1
InChIKeyNXSMGELJGPPCGV-HKUYNNGSSA-N
MW311.38 g/mol
LogP2.30
Rot. Bonds5

About (2S,3S)-2-hydroxy-3-morpholin-4-yl-1,3-diphenylpropan-1-one

(2S,3S)-2-hydroxy-3-morpholin-4-yl-1,3-diphenylpropan-1-one (PubChem CID 1481632) has the molecular formula C19H21NO3 and a molecular weight of 311.38 g/mol. Its IUPAC name is (2S,3S)-2-hydroxy-3-morpholin-4-yl-1,3-diphenylpropan-1-one.

Molecular Properties

Compound Name(2S,3S)-2-hydroxy-3-morpholin-4-yl-1,3-diphenylpropan-1-one
PubChem CID1481632
Molecular FormulaC19H21NO3
Molecular Weight311.38 g/mol
Exact Mass311.15
IUPAC Name(2S,3S)-2-hydroxy-3-morpholin-4-yl-1,3-diphenylpropan-1-one
SMILESO=C(c1ccccc1)[C@@H](O)[C@H](c1ccccc1)N1CCOCC1
InChIInChI=1S/C19H21NO3/c21-18(16-9-5-2-6-10-16)19(22)17(15-7-3-1-4-8-15)20-11-13-23-14-12-20/h1-10,17,19,22H,11-14H2/t17-,19-/m0/s1
InChIKeyNXSMGELJGPPCGV-HKUYNNGSSA-N
XLogP2.30
TPSA49.77 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500311.38
LogP ≤ 52.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(2R,3R)-2,3-dimorpholin-4-yl-1-(4-phenoxyphenyl)-3-phenylpropan-1-one
CID 92573674
(3S,4S)-3,4-dimorpholin-4-yl-4-phenylbutan-2-one
CID 680065
(2S,3S)-2,3-dimorpholin-4-yl-3-phenyl-1-(3-propan-2-ylphenyl)propan-1-one
CID 92573632
1-(4-chlorophenyl)-2-morpholin-4-yl-2-phenylethanone
CID 71319479
(2S,3S)-1-(3,4-dimethoxyphenyl)-2-hydroxy-3-(4-methylphenyl)-3-morpholin-4-ylpropan-1-one
CID 1481576
(2R)-2-morpholin-4-yl-1,3-diphenylpropan-1-one
CID 7000195
(2R,3S)-1-(4-butoxyphenyl)-2,3-dimorpholin-4-yl-3-phenylpropan-1-one
CID 92759233
(2R,3S)-2-methyl-1,3-diphenyl-3-pyrrolidin-1-ylpropan-1-one
CID 10637492
ethyl (2S,3S)-2,3-dimorpholin-4-yl-3-phenylpropanoate
CID 680324
1-(4-methoxyphenyl)-2-morpholin-4-yl-2-phenylethanone
CID 644374
methoxymethane;N-(1-morpholin-4-yl-2-oxo-2-phenylethyl)formamide
CID 21240768
1,2-dimorpholin-4-yl-2-phenylethanone
CID 657415

Frequently Asked Questions

What is the IUPAC name of (2S,3S)-2-hydroxy-3-morpholin-4-yl-1,3-diphenylpropan-1-one?
The IUPAC name of (2S,3S)-2-hydroxy-3-morpholin-4-yl-1,3-diphenylpropan-1-one (CID 1481632) is (2S,3S)-2-hydroxy-3-morpholin-4-yl-1,3-diphenylpropan-1-one.
What is the SMILES notation for (2S,3S)-2-hydroxy-3-morpholin-4-yl-1,3-diphenylpropan-1-one?
The canonical SMILES for (2S,3S)-2-hydroxy-3-morpholin-4-yl-1,3-diphenylpropan-1-one is O=C(c1ccccc1)[C@@H](O)[C@H](c1ccccc1)N1CCOCC1.
What is the InChIKey of (2S,3S)-2-hydroxy-3-morpholin-4-yl-1,3-diphenylpropan-1-one?
The InChIKey is NXSMGELJGPPCGV-HKUYNNGSSA-N. The full InChI is InChI=1S/C19H21NO3/c21-18(16-9-5-2-6-10-16)19(22)17(15-7-3-1-4-8-15)20-11-13-23-14-12-20/h1-10,17,19,22H,11-14H2/t17-,19-/m0/s1.
What are the key properties of (2S,3S)-2-hydroxy-3-morpholin-4-yl-1,3-diphenylpropan-1-one?
(2S,3S)-2-hydroxy-3-morpholin-4-yl-1,3-diphenylpropan-1-one has a molecular weight of 311.38 g/mol, XLogP of 2.30, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2S,3S)-2-hydroxy-3-morpholin-4-yl-1,3-diphenylpropan-1-one is sourced from PubChem (CID 1481632), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).