4-[(3-chlorophenyl)methyl]-2-[(2-methoxyphenoxy)methyl]morpholine

C19H22ClNO3 — CID 11428005

IUPAC4-[(3-chlorophenyl)methyl]-2-[(2-methoxyphenoxy)methyl]morpholine
SMILESCOc1ccccc1OCC1CN(Cc2cccc(Cl)c2)CCO1
InChIInChI=1S/C19H22ClNO3/c1-22-18-7-2-3-8-19(18)24-14-17-13-21(9-10-23-17)12-15-5-4-6-16(20)11-15/h2-8,11,17H,9-10,12-14H2,1H3
InChIKeyGUSPDCIUVZTXMP-UHFFFAOYSA-N
MW347.84 g/mol
LogP3.63
Rot. Bonds6

About 4-[(3-chlorophenyl)methyl]-2-[(2-methoxyphenoxy)methyl]morpholine

4-[(3-chlorophenyl)methyl]-2-[(2-methoxyphenoxy)methyl]morpholine (PubChem CID 11428005) has the molecular formula C19H22ClNO3 and a molecular weight of 347.84 g/mol. Its IUPAC name is 4-[(3-chlorophenyl)methyl]-2-[(2-methoxyphenoxy)methyl]morpholine.

Molecular Properties

Compound Name4-[(3-chlorophenyl)methyl]-2-[(2-methoxyphenoxy)methyl]morpholine
PubChem CID11428005
Molecular FormulaC19H22ClNO3
Molecular Weight347.84 g/mol
Exact Mass347.13
IUPAC Name4-[(3-chlorophenyl)methyl]-2-[(2-methoxyphenoxy)methyl]morpholine
SMILESCOc1ccccc1OCC1CN(Cc2cccc(Cl)c2)CCO1
InChIInChI=1S/C19H22ClNO3/c1-22-18-7-2-3-8-19(18)24-14-17-13-21(9-10-23-17)12-15-5-4-6-16(20)11-15/h2-8,11,17H,9-10,12-14H2,1H3
InChIKeyGUSPDCIUVZTXMP-UHFFFAOYSA-N
XLogP3.63
TPSA30.93 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500347.84
LogP ≤ 53.63
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 4-[(3-chlorophenyl)methyl]-2-[(2-methoxyphenoxy)methyl]morpholine 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 4-[(3-chlorophenyl)methyl]-2-[(2-methoxyphenoxy)methyl]morpholine?
The IUPAC name of 4-[(3-chlorophenyl)methyl]-2-[(2-methoxyphenoxy)methyl]morpholine (CID 11428005) is 4-[(3-chlorophenyl)methyl]-2-[(2-methoxyphenoxy)methyl]morpholine.
What is the SMILES notation for 4-[(3-chlorophenyl)methyl]-2-[(2-methoxyphenoxy)methyl]morpholine?
The canonical SMILES for 4-[(3-chlorophenyl)methyl]-2-[(2-methoxyphenoxy)methyl]morpholine is COc1ccccc1OCC1CN(Cc2cccc(Cl)c2)CCO1.
What is the InChIKey of 4-[(3-chlorophenyl)methyl]-2-[(2-methoxyphenoxy)methyl]morpholine?
The InChIKey is GUSPDCIUVZTXMP-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22ClNO3/c1-22-18-7-2-3-8-19(18)24-14-17-13-21(9-10-23-17)12-15-5-4-6-16(20)11-15/h2-8,11,17H,9-10,12-14H2,1H3.
What are the key properties of 4-[(3-chlorophenyl)methyl]-2-[(2-methoxyphenoxy)methyl]morpholine?
4-[(3-chlorophenyl)methyl]-2-[(2-methoxyphenoxy)methyl]morpholine has a molecular weight of 347.84 g/mol, XLogP of 3.63, 6 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(3-chlorophenyl)methyl]-2-[(2-methoxyphenoxy)methyl]morpholine is sourced from PubChem (CID 11428005), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).