(2S)-2-(3-methoxyphenoxy)-1-morpholin-4-ylpropan-1-one

C14H19NO4 — CID 92679202

IUPAC(2S)-2-(3-methoxyphenoxy)-1-morpholin-4-ylpropan-1-one
SMILESCOc1cccc(O[C@@H](C)C(=O)N2CCOCC2)c1
InChIInChI=1S/C14H19NO4/c1-11(14(16)15-6-8-18-9-7-15)19-13-5-3-4-12(10-13)17-2/h3-5,10-11H,6-9H2,1-2H3/t11-/m0/s1
InChIKeyHKPCWNQDLYMIFR-NSHDSACASA-N
MW265.31 g/mol
LogP1.32
Rot. Bonds4

About (2S)-2-(3-methoxyphenoxy)-1-morpholin-4-ylpropan-1-one

(2S)-2-(3-methoxyphenoxy)-1-morpholin-4-ylpropan-1-one (PubChem CID 92679202) has the molecular formula C14H19NO4 and a molecular weight of 265.31 g/mol. Its IUPAC name is (2S)-2-(3-methoxyphenoxy)-1-morpholin-4-ylpropan-1-one.

Molecular Properties

Compound Name(2S)-2-(3-methoxyphenoxy)-1-morpholin-4-ylpropan-1-one
PubChem CID92679202
Molecular FormulaC14H19NO4
Molecular Weight265.31 g/mol
Exact Mass265.13
IUPAC Name(2S)-2-(3-methoxyphenoxy)-1-morpholin-4-ylpropan-1-one
SMILESCOc1cccc(O[C@@H](C)C(=O)N2CCOCC2)c1
InChIInChI=1S/C14H19NO4/c1-11(14(16)15-6-8-18-9-7-15)19-13-5-3-4-12(10-13)17-2/h3-5,10-11H,6-9H2,1-2H3/t11-/m0/s1
InChIKeyHKPCWNQDLYMIFR-NSHDSACASA-N
XLogP1.32
TPSA48.00 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.31
LogP ≤ 51.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

(2S)-2-(3-chlorophenoxy)-1-morpholin-4-ylpropan-1-one
CID 898248
2-(3-iodophenoxy)-1-morpholin-4-ylpropan-1-one
CID 21101274
(2S)-1-morpholin-4-yl-2-(4-phenylphenoxy)propan-1-one
CID 734825
2-(3,4-difluorophenoxy)-1-morpholin-4-ylpropan-1-one
CID 78767959
(2S)-2-(3,5-dichlorophenoxy)-1-morpholin-4-ylpropan-1-one
CID 95165980
2-[[(1R)-1-(3-methoxyphenyl)ethyl]amino]-1-morpholin-4-ylpropan-1-one
CID 81354077
2-[4-(aminomethyl)phenoxy]-1-morpholin-4-ylpropan-1-one
CID 43115804
2-[4-(1-hydroxyethyl)phenoxy]-1-morpholin-4-ylpropan-1-one
CID 43503667
2-(3,5-dimethoxyphenoxy)-1-(4-phenylpiperazin-1-yl)propan-1-one
CID 17395855
1-(4-benzylpiperidin-1-yl)-2-(3-methoxyphenoxy)propan-1-one
CID 43905657
2-[4-(hydroxymethyl)phenoxy]-1-morpholin-4-ylpropan-1-one
CID 43083069
2-(3-hydroxy-2-methylphenoxy)-1-morpholin-4-ylpropan-1-one
CID 43143211

Frequently Asked Questions

What is the IUPAC name of (2S)-2-(3-methoxyphenoxy)-1-morpholin-4-ylpropan-1-one?
The IUPAC name of (2S)-2-(3-methoxyphenoxy)-1-morpholin-4-ylpropan-1-one (CID 92679202) is (2S)-2-(3-methoxyphenoxy)-1-morpholin-4-ylpropan-1-one.
What is the SMILES notation for (2S)-2-(3-methoxyphenoxy)-1-morpholin-4-ylpropan-1-one?
The canonical SMILES for (2S)-2-(3-methoxyphenoxy)-1-morpholin-4-ylpropan-1-one is COc1cccc(O[C@@H](C)C(=O)N2CCOCC2)c1.
What is the InChIKey of (2S)-2-(3-methoxyphenoxy)-1-morpholin-4-ylpropan-1-one?
The InChIKey is HKPCWNQDLYMIFR-NSHDSACASA-N. The full InChI is InChI=1S/C14H19NO4/c1-11(14(16)15-6-8-18-9-7-15)19-13-5-3-4-12(10-13)17-2/h3-5,10-11H,6-9H2,1-2H3/t11-/m0/s1.
What are the key properties of (2S)-2-(3-methoxyphenoxy)-1-morpholin-4-ylpropan-1-one?
(2S)-2-(3-methoxyphenoxy)-1-morpholin-4-ylpropan-1-one has a molecular weight of 265.31 g/mol, XLogP of 1.32, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-(3-methoxyphenoxy)-1-morpholin-4-ylpropan-1-one is sourced from PubChem (CID 92679202), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).