2-(bromomethyl)-6-methyl-4-[(4-methylmorpholin-2-yl)methyl]morpholine

C12H23BrN2O2 — CID 102936850

IUPAC2-(bromomethyl)-6-methyl-4-[(4-methylmorpholin-2-yl)methyl]morpholine
SMILESCC1CN(CC2CN(C)CCO2)CC(CBr)O1
InChIInChI=1S/C12H23BrN2O2/c1-10-6-15(8-11(5-13)17-10)9-12-7-14(2)3-4-16-12/h10-12H,3-9H2,1-2H3
InChIKeyUWLPNWRGCCIBKI-UHFFFAOYSA-N
MW307.23 g/mol
LogP0.80
Rot. Bonds3

About 2-(bromomethyl)-6-methyl-4-[(4-methylmorpholin-2-yl)methyl]morpholine

2-(bromomethyl)-6-methyl-4-[(4-methylmorpholin-2-yl)methyl]morpholine (PubChem CID 102936850) has the molecular formula C12H23BrN2O2 and a molecular weight of 307.23 g/mol. Its IUPAC name is 2-(bromomethyl)-6-methyl-4-[(4-methylmorpholin-2-yl)methyl]morpholine.

Molecular Properties

Compound Name2-(bromomethyl)-6-methyl-4-[(4-methylmorpholin-2-yl)methyl]morpholine
PubChem CID102936850
Molecular FormulaC12H23BrN2O2
Molecular Weight307.23 g/mol
Exact Mass306.09
IUPAC Name2-(bromomethyl)-6-methyl-4-[(4-methylmorpholin-2-yl)methyl]morpholine
SMILESCC1CN(CC2CN(C)CCO2)CC(CBr)O1
InChIInChI=1S/C12H23BrN2O2/c1-10-6-15(8-11(5-13)17-10)9-12-7-14(2)3-4-16-12/h10-12H,3-9H2,1-2H3
InChIKeyUWLPNWRGCCIBKI-UHFFFAOYSA-N
XLogP0.80
TPSA24.94 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.23
LogP ≤ 50.80
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze 2-(bromomethyl)-6-methyl-4-[(4-methylmorpholin-2-yl)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

Related Compounds

2-(bromomethyl)-4-(cyclopropylmethyl)-6-methylmorpholine
CID 102936772
(3R,4S)-1-[(4-methylmorpholin-2-yl)methyl]pyrrolidine-3,4-diol
CID 115278442
2-(bromomethyl)-4-(cyclohexylmethyl)-6-methylmorpholine
CID 102936836
ethane;4-methyl-2-(piperazin-1-ylmethyl)morpholine
CID 144702613
2-(bromomethyl)-4-butyl-6-methylmorpholine
CID 102936811
2-[2-(bromomethyl)-6-methylmorpholin-4-yl]-N,N-diethylethanamine
CID 107914046
ethane;2-ethyl-4-methylmorpholine;methane
CID 178051294
1-[(4-methylmorpholin-2-yl)methyl]piperidine-4-carbaldehyde
CID 79182827
2-[1-[(4-methylmorpholin-2-yl)methyl]piperidin-4-yl]ethanamine
CID 79172349
4-methyl-2-[(4-methylpiperazin-1-yl)methyl]-1,4-oxazepane
CID 54379759
2-(3,9-diazabicyclo[4.2.1]nonan-3-ylmethyl)-4-methylmorpholine
CID 115314333
1-[(4-methylmorpholin-2-yl)methyl]piperidine-4-carboxylic acid
CID 79182775

Frequently Asked Questions

What is the IUPAC name of 2-(bromomethyl)-6-methyl-4-[(4-methylmorpholin-2-yl)methyl]morpholine?
The IUPAC name of 2-(bromomethyl)-6-methyl-4-[(4-methylmorpholin-2-yl)methyl]morpholine (CID 102936850) is 2-(bromomethyl)-6-methyl-4-[(4-methylmorpholin-2-yl)methyl]morpholine.
What is the SMILES notation for 2-(bromomethyl)-6-methyl-4-[(4-methylmorpholin-2-yl)methyl]morpholine?
The canonical SMILES for 2-(bromomethyl)-6-methyl-4-[(4-methylmorpholin-2-yl)methyl]morpholine is CC1CN(CC2CN(C)CCO2)CC(CBr)O1.
What is the InChIKey of 2-(bromomethyl)-6-methyl-4-[(4-methylmorpholin-2-yl)methyl]morpholine?
The InChIKey is UWLPNWRGCCIBKI-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23BrN2O2/c1-10-6-15(8-11(5-13)17-10)9-12-7-14(2)3-4-16-12/h10-12H,3-9H2,1-2H3.
What are the key properties of 2-(bromomethyl)-6-methyl-4-[(4-methylmorpholin-2-yl)methyl]morpholine?
2-(bromomethyl)-6-methyl-4-[(4-methylmorpholin-2-yl)methyl]morpholine has a molecular weight of 307.23 g/mol, XLogP of 0.80, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(bromomethyl)-6-methyl-4-[(4-methylmorpholin-2-yl)methyl]morpholine is sourced from PubChem (CID 102936850), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).