2-hydroxy-3-morpholin-4-yl-1,3-diphenylpropan-1-one

C19H21NO3 — CID 3731291

IUPAC2-hydroxy-3-morpholin-4-yl-1,3-diphenylpropan-1-one
SMILESO=C(c1ccccc1)C(O)C(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
InChIKeyNXSMGELJGPPCGV-UHFFFAOYSA-N
MW311.38 g/mol
LogP2.30
Rot. Bonds5

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

2-hydroxy-3-morpholin-4-yl-1,3-diphenylpropan-1-one (PubChem CID 3731291) has the molecular formula C19H21NO3 and a molecular weight of 311.38 g/mol. Its IUPAC name is 2-hydroxy-3-morpholin-4-yl-1,3-diphenylpropan-1-one.

Molecular Properties

Compound Name2-hydroxy-3-morpholin-4-yl-1,3-diphenylpropan-1-one
PubChem CID3731291
Molecular FormulaC19H21NO3
Molecular Weight311.38 g/mol
Exact Mass311.15
IUPAC Name2-hydroxy-3-morpholin-4-yl-1,3-diphenylpropan-1-one
SMILESO=C(c1ccccc1)C(O)C(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
InChIKeyNXSMGELJGPPCGV-UHFFFAOYSA-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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Frequently Asked Questions

What is the IUPAC name of 2-hydroxy-3-morpholin-4-yl-1,3-diphenylpropan-1-one?
The IUPAC name of 2-hydroxy-3-morpholin-4-yl-1,3-diphenylpropan-1-one (CID 3731291) is 2-hydroxy-3-morpholin-4-yl-1,3-diphenylpropan-1-one.
What is the SMILES notation for 2-hydroxy-3-morpholin-4-yl-1,3-diphenylpropan-1-one?
The canonical SMILES for 2-hydroxy-3-morpholin-4-yl-1,3-diphenylpropan-1-one is O=C(c1ccccc1)C(O)C(c1ccccc1)N1CCOCC1.
What is the InChIKey of 2-hydroxy-3-morpholin-4-yl-1,3-diphenylpropan-1-one?
The InChIKey is NXSMGELJGPPCGV-UHFFFAOYSA-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.
What are the key properties of 2-hydroxy-3-morpholin-4-yl-1,3-diphenylpropan-1-one?
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 2-hydroxy-3-morpholin-4-yl-1,3-diphenylpropan-1-one is sourced from PubChem (CID 3731291), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).