2-[2-(1-hydroxyethyl)-4-methylphenoxy]-1-morpholin-4-ylpropan-1-one

C16H23NO4 — CID 43505242

IUPAC2-[2-(1-hydroxyethyl)-4-methylphenoxy]-1-morpholin-4-ylpropan-1-one
SMILESCc1ccc(OC(C)C(=O)N2CCOCC2)c(C(C)O)c1
InChIInChI=1S/C16H23NO4/c1-11-4-5-15(14(10-11)12(2)18)21-13(3)16(19)17-6-8-20-9-7-17/h4-5,10,12-13,18H,6-9H2,1-3H3
InChIKeySKGJBWAFYMEOLA-UHFFFAOYSA-N
MW293.36 g/mol
LogP1.67
Rot. Bonds4

About 2-[2-(1-hydroxyethyl)-4-methylphenoxy]-1-morpholin-4-ylpropan-1-one

2-[2-(1-hydroxyethyl)-4-methylphenoxy]-1-morpholin-4-ylpropan-1-one (PubChem CID 43505242) has the molecular formula C16H23NO4 and a molecular weight of 293.36 g/mol. Its IUPAC name is 2-[2-(1-hydroxyethyl)-4-methylphenoxy]-1-morpholin-4-ylpropan-1-one.

Molecular Properties

Compound Name2-[2-(1-hydroxyethyl)-4-methylphenoxy]-1-morpholin-4-ylpropan-1-one
PubChem CID43505242
Molecular FormulaC16H23NO4
Molecular Weight293.36 g/mol
Exact Mass293.16
IUPAC Name2-[2-(1-hydroxyethyl)-4-methylphenoxy]-1-morpholin-4-ylpropan-1-one
SMILESCc1ccc(OC(C)C(=O)N2CCOCC2)c(C(C)O)c1
InChIInChI=1S/C16H23NO4/c1-11-4-5-15(14(10-11)12(2)18)21-13(3)16(19)17-6-8-20-9-7-17/h4-5,10,12-13,18H,6-9H2,1-3H3
InChIKeySKGJBWAFYMEOLA-UHFFFAOYSA-N
XLogP1.67
TPSA59.00 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.36
LogP ≤ 51.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 2-[2-(1-hydroxyethyl)-4-methylphenoxy]-1-morpholin-4-ylpropan-1-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-[2-(1-hydroxyethyl)-4-methylphenoxy]-1-morpholin-4-ylpropan-1-one?
The IUPAC name of 2-[2-(1-hydroxyethyl)-4-methylphenoxy]-1-morpholin-4-ylpropan-1-one (CID 43505242) is 2-[2-(1-hydroxyethyl)-4-methylphenoxy]-1-morpholin-4-ylpropan-1-one.
What is the SMILES notation for 2-[2-(1-hydroxyethyl)-4-methylphenoxy]-1-morpholin-4-ylpropan-1-one?
The canonical SMILES for 2-[2-(1-hydroxyethyl)-4-methylphenoxy]-1-morpholin-4-ylpropan-1-one is Cc1ccc(OC(C)C(=O)N2CCOCC2)c(C(C)O)c1.
What is the InChIKey of 2-[2-(1-hydroxyethyl)-4-methylphenoxy]-1-morpholin-4-ylpropan-1-one?
The InChIKey is SKGJBWAFYMEOLA-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23NO4/c1-11-4-5-15(14(10-11)12(2)18)21-13(3)16(19)17-6-8-20-9-7-17/h4-5,10,12-13,18H,6-9H2,1-3H3.
What are the key properties of 2-[2-(1-hydroxyethyl)-4-methylphenoxy]-1-morpholin-4-ylpropan-1-one?
2-[2-(1-hydroxyethyl)-4-methylphenoxy]-1-morpholin-4-ylpropan-1-one has a molecular weight of 293.36 g/mol, XLogP of 1.67, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(1-hydroxyethyl)-4-methylphenoxy]-1-morpholin-4-ylpropan-1-one is sourced from PubChem (CID 43505242), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).