3-[2-(5-chloro-2-methoxy-3-methylphenyl)ethyl]morpholine

C14H20ClNO2 — CID 116928217

IUPAC3-[2-(5-chloro-2-methoxy-3-methylphenyl)ethyl]morpholine
SMILESCOc1c(C)cc(Cl)cc1CCC1COCCN1
InChIInChI=1S/C14H20ClNO2/c1-10-7-12(15)8-11(14(10)17-2)3-4-13-9-18-6-5-16-13/h7-8,13,16H,3-6,9H2,1-2H3
InChIKeyFGHLBYXWVVPONV-UHFFFAOYSA-N
MW269.77 g/mol
LogP2.58
Rot. Bonds4

About 3-[2-(5-chloro-2-methoxy-3-methylphenyl)ethyl]morpholine

3-[2-(5-chloro-2-methoxy-3-methylphenyl)ethyl]morpholine (PubChem CID 116928217) has the molecular formula C14H20ClNO2 and a molecular weight of 269.77 g/mol. Its IUPAC name is 3-[2-(5-chloro-2-methoxy-3-methylphenyl)ethyl]morpholine.

Molecular Properties

Compound Name3-[2-(5-chloro-2-methoxy-3-methylphenyl)ethyl]morpholine
PubChem CID116928217
Molecular FormulaC14H20ClNO2
Molecular Weight269.77 g/mol
Exact Mass269.12
IUPAC Name3-[2-(5-chloro-2-methoxy-3-methylphenyl)ethyl]morpholine
SMILESCOc1c(C)cc(Cl)cc1CCC1COCCN1
InChIInChI=1S/C14H20ClNO2/c1-10-7-12(15)8-11(14(10)17-2)3-4-13-9-18-6-5-16-13/h7-8,13,16H,3-6,9H2,1-2H3
InChIKeyFGHLBYXWVVPONV-UHFFFAOYSA-N
XLogP2.58
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.77
LogP ≤ 52.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 3-[2-(5-chloro-2-methoxy-3-methylphenyl)ethyl]morpholine with MolForge

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

Launch Full Analysis

Related Compounds

3-[2-(2-chloro-5-fluoro-4-methylphenyl)ethyl]morpholine
CID 116928267
3-[2-(5-chloro-2-methoxy-3-methylphenyl)ethyl]pyrrolidine
CID 116925460
3-[2-(4-methoxy-3-methylphenyl)ethyl]morpholine
CID 116928186
3-[2-(2-methoxy-4,6-dimethylphenyl)ethyl]morpholine
CID 116928232
N-[(2-methoxy-3,5-dimethylphenyl)methyl]-1-morpholin-3-ylmethanamine
CID 115238028
2-[(5-chloro-2-methoxy-3-methylphenyl)methyl]piperazine
CID 116825296
3-[(4-chloro-2-methylphenyl)methyl]morpholine
CID 82287728
3-[(5-chloro-2-methoxy-4-methylphenyl)methyl]morpholine
CID 116927929
3-[(5-chloro-2-methoxyphenyl)methyl]morpholine
CID 82293165
N-[(4-methoxy-3,5-dimethylphenyl)methyl]-1-morpholin-3-ylmethanamine
CID 115238057
1-(4-methoxy-3,5-dimethylphenyl)-2-morpholin-3-ylethanamine
CID 116941537
3-[(5-chloro-2-methoxy-3-methylphenyl)methyl]azetidine
CID 82287755

Frequently Asked Questions

What is the IUPAC name of 3-[2-(5-chloro-2-methoxy-3-methylphenyl)ethyl]morpholine?
The IUPAC name of 3-[2-(5-chloro-2-methoxy-3-methylphenyl)ethyl]morpholine (CID 116928217) is 3-[2-(5-chloro-2-methoxy-3-methylphenyl)ethyl]morpholine.
What is the SMILES notation for 3-[2-(5-chloro-2-methoxy-3-methylphenyl)ethyl]morpholine?
The canonical SMILES for 3-[2-(5-chloro-2-methoxy-3-methylphenyl)ethyl]morpholine is COc1c(C)cc(Cl)cc1CCC1COCCN1.
What is the InChIKey of 3-[2-(5-chloro-2-methoxy-3-methylphenyl)ethyl]morpholine?
The InChIKey is FGHLBYXWVVPONV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20ClNO2/c1-10-7-12(15)8-11(14(10)17-2)3-4-13-9-18-6-5-16-13/h7-8,13,16H,3-6,9H2,1-2H3.
What are the key properties of 3-[2-(5-chloro-2-methoxy-3-methylphenyl)ethyl]morpholine?
3-[2-(5-chloro-2-methoxy-3-methylphenyl)ethyl]morpholine has a molecular weight of 269.77 g/mol, XLogP of 2.58, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[2-(5-chloro-2-methoxy-3-methylphenyl)ethyl]morpholine is sourced from PubChem (CID 116928217), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).