N,N-dibenzyl-2-(4-methylmorpholin-2-yl)ethanamine

C21H28N2O — CID 171383879

IUPACN,N-dibenzyl-2-(4-methylmorpholin-2-yl)ethanamine
SMILESCN1CCOC(CCN(Cc2ccccc2)Cc2ccccc2)C1
InChIInChI=1S/C21H28N2O/c1-22-14-15-24-21(18-22)12-13-23(16-19-8-4-2-5-9-19)17-20-10-6-3-7-11-20/h2-11,21H,12-18H2,1H3
InChIKeyQHNJOFKWXBZRJV-UHFFFAOYSA-N
MW324.47 g/mol
LogP3.41
Rot. Bonds7

About N,N-dibenzyl-2-(4-methylmorpholin-2-yl)ethanamine

N,N-dibenzyl-2-(4-methylmorpholin-2-yl)ethanamine (PubChem CID 171383879) has the molecular formula C21H28N2O and a molecular weight of 324.47 g/mol. Its IUPAC name is N,N-dibenzyl-2-(4-methylmorpholin-2-yl)ethanamine.

Molecular Properties

Compound NameN,N-dibenzyl-2-(4-methylmorpholin-2-yl)ethanamine
PubChem CID171383879
Molecular FormulaC21H28N2O
Molecular Weight324.47 g/mol
Exact Mass324.22
IUPAC NameN,N-dibenzyl-2-(4-methylmorpholin-2-yl)ethanamine
SMILESCN1CCOC(CCN(Cc2ccccc2)Cc2ccccc2)C1
InChIInChI=1S/C21H28N2O/c1-22-14-15-24-21(18-22)12-13-23(16-19-8-4-2-5-9-19)17-20-10-6-3-7-11-20/h2-11,21H,12-18H2,1H3
InChIKeyQHNJOFKWXBZRJV-UHFFFAOYSA-N
XLogP3.41
TPSA15.71 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.47
LogP ≤ 53.41
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze N,N-dibenzyl-2-(4-methylmorpholin-2-yl)ethanamine 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

Trifenmorph
CID 14993
N,N-Dibenzylethanolamine
CID 22657
4-(2,2-Diphenylethyl)morpholine
CID 240345
7,16-Dibenzyl-1,4,10,13-tetraoxa-7,16-diazacyclooctadecane
CID 3308751
Jnj-10181457
CID 9944610
2,6-Dimethyl-4-(1-(4-methylbenzyl)piperidin-4-yl)morpholine hydrochloride
CID 24761181
Dimorpholinophenylmethane
CID 80899
3-Morpholin-4-ylmethyl-benzylamine
CID 6484182
4-Benzylmorpholine
CID 249546
4-Benzyl-2-(2-phenylethyl)morpholine
CID 20354789
4-Benzylmorpholine hydrochloride
CID 2849468
[(2R)-1,4-dibenzylpiperazin-2-yl]methanol
CID 9994741

Frequently Asked Questions

What is the IUPAC name of N,N-dibenzyl-2-(4-methylmorpholin-2-yl)ethanamine?
The IUPAC name of N,N-dibenzyl-2-(4-methylmorpholin-2-yl)ethanamine (CID 171383879) is N,N-dibenzyl-2-(4-methylmorpholin-2-yl)ethanamine.
What is the SMILES notation for N,N-dibenzyl-2-(4-methylmorpholin-2-yl)ethanamine?
The canonical SMILES for N,N-dibenzyl-2-(4-methylmorpholin-2-yl)ethanamine is CN1CCOC(CCN(Cc2ccccc2)Cc2ccccc2)C1.
What is the InChIKey of N,N-dibenzyl-2-(4-methylmorpholin-2-yl)ethanamine?
The InChIKey is QHNJOFKWXBZRJV-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H28N2O/c1-22-14-15-24-21(18-22)12-13-23(16-19-8-4-2-5-9-19)17-20-10-6-3-7-11-20/h2-11,21H,12-18H2,1H3.
What are the key properties of N,N-dibenzyl-2-(4-methylmorpholin-2-yl)ethanamine?
N,N-dibenzyl-2-(4-methylmorpholin-2-yl)ethanamine has a molecular weight of 324.47 g/mol, XLogP of 3.41, 7 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dibenzyl-2-(4-methylmorpholin-2-yl)ethanamine is sourced from PubChem (CID 171383879), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).