2-(3-hydroxy-2-methylphenoxy)-1-morpholin-4-ylpropan-1-one

C14H19NO4 — CID 43143211

IUPAC2-(3-hydroxy-2-methylphenoxy)-1-morpholin-4-ylpropan-1-one
SMILESCc1c(O)cccc1OC(C)C(=O)N1CCOCC1
InChIInChI=1S/C14H19NO4/c1-10-12(16)4-3-5-13(10)19-11(2)14(17)15-6-8-18-9-7-15/h3-5,11,16H,6-9H2,1-2H3
InChIKeyFGNYMQLKEGPDCW-UHFFFAOYSA-N
MW265.31 g/mol
LogP1.33
Rot. Bonds3

About 2-(3-hydroxy-2-methylphenoxy)-1-morpholin-4-ylpropan-1-one

2-(3-hydroxy-2-methylphenoxy)-1-morpholin-4-ylpropan-1-one (PubChem CID 43143211) has the molecular formula C14H19NO4 and a molecular weight of 265.31 g/mol. Its IUPAC name is 2-(3-hydroxy-2-methylphenoxy)-1-morpholin-4-ylpropan-1-one.

Molecular Properties

Compound Name2-(3-hydroxy-2-methylphenoxy)-1-morpholin-4-ylpropan-1-one
PubChem CID43143211
Molecular FormulaC14H19NO4
Molecular Weight265.31 g/mol
Exact Mass265.13
IUPAC Name2-(3-hydroxy-2-methylphenoxy)-1-morpholin-4-ylpropan-1-one
SMILESCc1c(O)cccc1OC(C)C(=O)N1CCOCC1
InChIInChI=1S/C14H19NO4/c1-10-12(16)4-3-5-13(10)19-11(2)14(17)15-6-8-18-9-7-15/h3-5,11,16H,6-9H2,1-2H3
InChIKeyFGNYMQLKEGPDCW-UHFFFAOYSA-N
XLogP1.33
TPSA59.00 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.31
LogP ≤ 51.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(2-fluorophenoxy)-1-morpholin-4-ylpropan-1-one
CID 60627807
2-(2-acetylphenoxy)-1-morpholin-4-ylpropan-1-one
CID 43083116
2-(2,3-dimethylphenoxy)-1-pyrrolidin-1-ylpropan-1-one
CID 42904169
2-(3-amino-2-methylphenoxy)-1-(azepan-1-yl)propan-1-one
CID 43437815
1-(azepan-1-yl)-2-(2,3-dimethylphenoxy)propan-1-one
CID 43908541
(2S)-2-(3-methoxyphenoxy)-1-morpholin-4-ylpropan-1-one
CID 92679202
(2S)-2-(3-chlorophenoxy)-1-morpholin-4-ylpropan-1-one
CID 898248
2-(3-iodophenoxy)-1-morpholin-4-ylpropan-1-one
CID 21101274
2-[2-(1-hydroxyethyl)-4-methylphenoxy]-1-morpholin-4-ylpropan-1-one
CID 43505242
2-(2-acetyl-5-fluorophenoxy)-1-morpholin-4-ylpropan-1-one
CID 63067650
(2S)-1-morpholin-4-yl-2-(4-phenylphenoxy)propan-1-one
CID 734825
5-bromo-2-(1-morpholin-4-yl-1-oxopropan-2-yl)oxybenzoic acid
CID 43084682

Frequently Asked Questions

What is the IUPAC name of 2-(3-hydroxy-2-methylphenoxy)-1-morpholin-4-ylpropan-1-one?
The IUPAC name of 2-(3-hydroxy-2-methylphenoxy)-1-morpholin-4-ylpropan-1-one (CID 43143211) is 2-(3-hydroxy-2-methylphenoxy)-1-morpholin-4-ylpropan-1-one.
What is the SMILES notation for 2-(3-hydroxy-2-methylphenoxy)-1-morpholin-4-ylpropan-1-one?
The canonical SMILES for 2-(3-hydroxy-2-methylphenoxy)-1-morpholin-4-ylpropan-1-one is Cc1c(O)cccc1OC(C)C(=O)N1CCOCC1.
What is the InChIKey of 2-(3-hydroxy-2-methylphenoxy)-1-morpholin-4-ylpropan-1-one?
The InChIKey is FGNYMQLKEGPDCW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19NO4/c1-10-12(16)4-3-5-13(10)19-11(2)14(17)15-6-8-18-9-7-15/h3-5,11,16H,6-9H2,1-2H3.
What are the key properties of 2-(3-hydroxy-2-methylphenoxy)-1-morpholin-4-ylpropan-1-one?
2-(3-hydroxy-2-methylphenoxy)-1-morpholin-4-ylpropan-1-one has a molecular weight of 265.31 g/mol, XLogP of 1.33, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-hydroxy-2-methylphenoxy)-1-morpholin-4-ylpropan-1-one is sourced from PubChem (CID 43143211), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).