1-morpholin-4-yl-2-(4-phenylphenoxy)propan-1-one

C19H21NO3 — CID 2968920

IUPAC1-morpholin-4-yl-2-(4-phenylphenoxy)propan-1-one
SMILESCC(Oc1ccc(-c2ccccc2)cc1)C(=O)N1CCOCC1
InChIInChI=1S/C19H21NO3/c1-15(19(21)20-11-13-22-14-12-20)23-18-9-7-17(8-10-18)16-5-3-2-4-6-16/h2-10,15H,11-14H2,1H3
InChIKeyDXIKPLIZDQJDKL-UHFFFAOYSA-N
MW311.38 g/mol
LogP2.98
Rot. Bonds4

About 1-morpholin-4-yl-2-(4-phenylphenoxy)propan-1-one

1-morpholin-4-yl-2-(4-phenylphenoxy)propan-1-one (PubChem CID 2968920) has the molecular formula C19H21NO3 and a molecular weight of 311.38 g/mol. Its IUPAC name is 1-morpholin-4-yl-2-(4-phenylphenoxy)propan-1-one.

Molecular Properties

Compound Name1-morpholin-4-yl-2-(4-phenylphenoxy)propan-1-one
PubChem CID2968920
Molecular FormulaC19H21NO3
Molecular Weight311.38 g/mol
Exact Mass311.15
IUPAC Name1-morpholin-4-yl-2-(4-phenylphenoxy)propan-1-one
SMILESCC(Oc1ccc(-c2ccccc2)cc1)C(=O)N1CCOCC1
InChIInChI=1S/C19H21NO3/c1-15(19(21)20-11-13-22-14-12-20)23-18-9-7-17(8-10-18)16-5-3-2-4-6-16/h2-10,15H,11-14H2,1H3
InChIKeyDXIKPLIZDQJDKL-UHFFFAOYSA-N
XLogP2.98
TPSA38.77 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500311.38
LogP ≤ 52.98
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-morpholin-4-yl-2-(4-phenylphenoxy)propan-1-one?
The IUPAC name of 1-morpholin-4-yl-2-(4-phenylphenoxy)propan-1-one (CID 2968920) is 1-morpholin-4-yl-2-(4-phenylphenoxy)propan-1-one.
What is the SMILES notation for 1-morpholin-4-yl-2-(4-phenylphenoxy)propan-1-one?
The canonical SMILES for 1-morpholin-4-yl-2-(4-phenylphenoxy)propan-1-one is CC(Oc1ccc(-c2ccccc2)cc1)C(=O)N1CCOCC1.
What is the InChIKey of 1-morpholin-4-yl-2-(4-phenylphenoxy)propan-1-one?
The InChIKey is DXIKPLIZDQJDKL-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21NO3/c1-15(19(21)20-11-13-22-14-12-20)23-18-9-7-17(8-10-18)16-5-3-2-4-6-16/h2-10,15H,11-14H2,1H3.
What are the key properties of 1-morpholin-4-yl-2-(4-phenylphenoxy)propan-1-one?
1-morpholin-4-yl-2-(4-phenylphenoxy)propan-1-one has a molecular weight of 311.38 g/mol, XLogP of 2.98, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-morpholin-4-yl-2-(4-phenylphenoxy)propan-1-one is sourced from PubChem (CID 2968920), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).