3-(2-hydroxyphenyl)-1-morpholin-4-yl-3-phenylpropan-1-one

C19H21NO3 — CID 2852618

IUPAC3-(2-hydroxyphenyl)-1-morpholin-4-yl-3-phenylpropan-1-one
SMILESO=C(CC(c1ccccc1)c1ccccc1O)N1CCOCC1
InChIInChI=1S/C19H21NO3/c21-18-9-5-4-8-16(18)17(15-6-2-1-3-7-15)14-19(22)20-10-12-23-13-11-20/h1-9,17,21H,10-14H2
InChIKeySCVKIFYWDXYFIN-UHFFFAOYSA-N
MW311.38 g/mol
LogP2.77
Rot. Bonds4

About 3-(2-hydroxyphenyl)-1-morpholin-4-yl-3-phenylpropan-1-one

3-(2-hydroxyphenyl)-1-morpholin-4-yl-3-phenylpropan-1-one (PubChem CID 2852618) has the molecular formula C19H21NO3 and a molecular weight of 311.38 g/mol. Its IUPAC name is 3-(2-hydroxyphenyl)-1-morpholin-4-yl-3-phenylpropan-1-one.

Molecular Properties

Compound Name3-(2-hydroxyphenyl)-1-morpholin-4-yl-3-phenylpropan-1-one
PubChem CID2852618
Molecular FormulaC19H21NO3
Molecular Weight311.38 g/mol
Exact Mass311.15
IUPAC Name3-(2-hydroxyphenyl)-1-morpholin-4-yl-3-phenylpropan-1-one
SMILESO=C(CC(c1ccccc1)c1ccccc1O)N1CCOCC1
InChIInChI=1S/C19H21NO3/c21-18-9-5-4-8-16(18)17(15-6-2-1-3-7-15)14-19(22)20-10-12-23-13-11-20/h1-9,17,21H,10-14H2
InChIKeySCVKIFYWDXYFIN-UHFFFAOYSA-N
XLogP2.77
TPSA49.77 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500311.38
LogP ≤ 52.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-(2-hydroxyphenyl)-1-morpholin-4-yl-3-phenylpropan-1-one?
The IUPAC name of 3-(2-hydroxyphenyl)-1-morpholin-4-yl-3-phenylpropan-1-one (CID 2852618) is 3-(2-hydroxyphenyl)-1-morpholin-4-yl-3-phenylpropan-1-one.
What is the SMILES notation for 3-(2-hydroxyphenyl)-1-morpholin-4-yl-3-phenylpropan-1-one?
The canonical SMILES for 3-(2-hydroxyphenyl)-1-morpholin-4-yl-3-phenylpropan-1-one is O=C(CC(c1ccccc1)c1ccccc1O)N1CCOCC1.
What is the InChIKey of 3-(2-hydroxyphenyl)-1-morpholin-4-yl-3-phenylpropan-1-one?
The InChIKey is SCVKIFYWDXYFIN-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21NO3/c21-18-9-5-4-8-16(18)17(15-6-2-1-3-7-15)14-19(22)20-10-12-23-13-11-20/h1-9,17,21H,10-14H2.
What are the key properties of 3-(2-hydroxyphenyl)-1-morpholin-4-yl-3-phenylpropan-1-one?
3-(2-hydroxyphenyl)-1-morpholin-4-yl-3-phenylpropan-1-one has a molecular weight of 311.38 g/mol, XLogP of 2.77, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-hydroxyphenyl)-1-morpholin-4-yl-3-phenylpropan-1-one is sourced from PubChem (CID 2852618), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).