2-(chloromethyl)-6-methyl-4-(2-propan-2-yloxyethyl)morpholine

C11H22ClNO2 — CID 102936700

IUPAC2-(chloromethyl)-6-methyl-4-(2-propan-2-yloxyethyl)morpholine
SMILESCC(C)OCCN1CC(C)OC(CCl)C1
InChIInChI=1S/C11H22ClNO2/c1-9(2)14-5-4-13-7-10(3)15-11(6-12)8-13/h9-11H,4-8H2,1-3H3
InChIKeyKUFGPYSFJUCCLI-UHFFFAOYSA-N
MW235.75 g/mol
LogP1.74
Rot. Bonds5

About 2-(chloromethyl)-6-methyl-4-(2-propan-2-yloxyethyl)morpholine

2-(chloromethyl)-6-methyl-4-(2-propan-2-yloxyethyl)morpholine (PubChem CID 102936700) has the molecular formula C11H22ClNO2 and a molecular weight of 235.75 g/mol. Its IUPAC name is 2-(chloromethyl)-6-methyl-4-(2-propan-2-yloxyethyl)morpholine.

Molecular Properties

Compound Name2-(chloromethyl)-6-methyl-4-(2-propan-2-yloxyethyl)morpholine
PubChem CID102936700
Molecular FormulaC11H22ClNO2
Molecular Weight235.75 g/mol
Exact Mass235.13
IUPAC Name2-(chloromethyl)-6-methyl-4-(2-propan-2-yloxyethyl)morpholine
SMILESCC(C)OCCN1CC(C)OC(CCl)C1
InChIInChI=1S/C11H22ClNO2/c1-9(2)14-5-4-13-7-10(3)15-11(6-12)8-13/h9-11H,4-8H2,1-3H3
InChIKeyKUFGPYSFJUCCLI-UHFFFAOYSA-N
XLogP1.74
TPSA21.70 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.75
LogP ≤ 51.74
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'alkyl_halide', 'substructure': 'N/A'}

Analyze 2-(chloromethyl)-6-methyl-4-(2-propan-2-yloxyethyl)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

2-(chloromethyl)-6-methyl-4-(3-methylbutyl)morpholine
CID 102936623
2-(chloromethyl)-6-methyl-4-(4-methylpentyl)morpholine
CID 102936587
2-(chloromethyl)-4-(4-methoxybutyl)-6-methylmorpholine
CID 102936556
2,6-dimethyl-4-(3-propan-2-yloxypropyl)morpholine
CID 154661277
2-(chloromethyl)-4-(3,3-dimethylbutyl)-6-methylmorpholine
CID 102936701
2-[2-(chloromethyl)-6-methylmorpholin-4-yl]-N,N-diethylethanamine
CID 107914043
2-[2-[2-(hydroxymethyl)-6-methylmorpholin-4-yl]ethoxy]ethanol
CID 102934999
2-(chloromethyl)-6-methyl-4-[(1-methylpyrazol-4-yl)methyl]morpholine
CID 102936721
2-(chloromethyl)-6-methyl-4-[3-(oxolan-2-yl)propyl]morpholine
CID 102936612
2-(chloromethyl)-6-methyl-4-(pyridin-4-ylmethyl)morpholine
CID 102936755
4-[(4-bromophenyl)methyl]-2-(chloromethyl)-6-methylmorpholine
CID 102936655
(2S,6R)-4-(2-methoxyethyl)-2,6-dimethylmorpholine
CID 89016342

Frequently Asked Questions

What is the IUPAC name of 2-(chloromethyl)-6-methyl-4-(2-propan-2-yloxyethyl)morpholine?
The IUPAC name of 2-(chloromethyl)-6-methyl-4-(2-propan-2-yloxyethyl)morpholine (CID 102936700) is 2-(chloromethyl)-6-methyl-4-(2-propan-2-yloxyethyl)morpholine.
What is the SMILES notation for 2-(chloromethyl)-6-methyl-4-(2-propan-2-yloxyethyl)morpholine?
The canonical SMILES for 2-(chloromethyl)-6-methyl-4-(2-propan-2-yloxyethyl)morpholine is CC(C)OCCN1CC(C)OC(CCl)C1.
What is the InChIKey of 2-(chloromethyl)-6-methyl-4-(2-propan-2-yloxyethyl)morpholine?
The InChIKey is KUFGPYSFJUCCLI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22ClNO2/c1-9(2)14-5-4-13-7-10(3)15-11(6-12)8-13/h9-11H,4-8H2,1-3H3.
What are the key properties of 2-(chloromethyl)-6-methyl-4-(2-propan-2-yloxyethyl)morpholine?
2-(chloromethyl)-6-methyl-4-(2-propan-2-yloxyethyl)morpholine has a molecular weight of 235.75 g/mol, XLogP of 1.74, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(chloromethyl)-6-methyl-4-(2-propan-2-yloxyethyl)morpholine is sourced from PubChem (CID 102936700), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).