4-[2-(1-benzyl-4-propan-2-ylcyclohexyl)oxyethyl]morpholine

C22H35NO2 — CID 21025514

IUPAC4-[2-(1-benzyl-4-propan-2-ylcyclohexyl)oxyethyl]morpholine
SMILESCC(C)C1CCC(Cc2ccccc2)(OCCN2CCOCC2)CC1
InChIInChI=1S/C22H35NO2/c1-19(2)21-8-10-22(11-9-21,18-20-6-4-3-5-7-20)25-17-14-23-12-15-24-16-13-23/h3-7,19,21H,8-18H2,1-2H3
InChIKeyLDHVDQBLHZVPSF-UHFFFAOYSA-N
MW345.53 g/mol
LogP4.16
Rot. Bonds7

About 4-[2-(1-benzyl-4-propan-2-ylcyclohexyl)oxyethyl]morpholine

4-[2-(1-benzyl-4-propan-2-ylcyclohexyl)oxyethyl]morpholine (PubChem CID 21025514) has the molecular formula C22H35NO2 and a molecular weight of 345.53 g/mol. Its IUPAC name is 4-[2-(1-benzyl-4-propan-2-ylcyclohexyl)oxyethyl]morpholine.

Molecular Properties

Compound Name4-[2-(1-benzyl-4-propan-2-ylcyclohexyl)oxyethyl]morpholine
PubChem CID21025514
Molecular FormulaC22H35NO2
Molecular Weight345.53 g/mol
Exact Mass345.27
IUPAC Name4-[2-(1-benzyl-4-propan-2-ylcyclohexyl)oxyethyl]morpholine
SMILESCC(C)C1CCC(Cc2ccccc2)(OCCN2CCOCC2)CC1
InChIInChI=1S/C22H35NO2/c1-19(2)21-8-10-22(11-9-21,18-20-6-4-3-5-7-20)25-17-14-23-12-15-24-16-13-23/h3-7,19,21H,8-18H2,1-2H3
InChIKeyLDHVDQBLHZVPSF-UHFFFAOYSA-N
XLogP4.16
TPSA21.70 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500345.53
LogP ≤ 54.16
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 4-[2-(1-benzyl-4-propan-2-ylcyclohexyl)oxyethyl]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

1-Cyclohexyl-4-morpholin-4-yl-1-phenyl-but-2-yn-1-ol
CID 413859
N,N-diethyl-2-[(1R,2R)-2-phenylcyclohexyl]oxyethanamine;hydrochloride
CID 70682929
N,N-diethyl-2-[(1S,2R)-2-phenylcyclohexyl]oxyethanamine;hydrochloride
CID 70695519
[(2R,5S)-5-benzhydryl-1,4-dioxan-2-yl]methyl-trimethylazanium iodide
CID 156013386
[(2R,5R)-5-benzhydryl-1,4-dioxan-2-yl]methyl-trimethylazanium iodide
CID 156020203
[(2R,6S)-6-benzhydryl-1,4-dioxan-2-yl]methyl-trimethylazanium iodide
CID 57326236
Ammonium, diisopropyl(2-(2,2-diphenylethoxy)ethyl)methyl-, iodide
CID 59501
Ammonium, diisopropyl(2-(3,3-diphenylpropoxy)ethyl)methyl-, iodide
CID 59505
4-(4-Cyclohexyl-4-hydroxy-4-phenylbut-2-yn-1-yl)-4-methylmorpholin-4-ium bromide
CID 200569
Cyclohexanol, 1-(p-(3-morpholinopropyl)phenethyl)-
CID 203648
N,N-Diethyl-2-(2-phenylpropoxy)propan-1-amine
CID 213813
Triethylamine, 2-(1,2,3,4-tetrahydro-2-naphthyloxy)-
CID 213816

Frequently Asked Questions

What is the IUPAC name of 4-[2-(1-benzyl-4-propan-2-ylcyclohexyl)oxyethyl]morpholine?
The IUPAC name of 4-[2-(1-benzyl-4-propan-2-ylcyclohexyl)oxyethyl]morpholine (CID 21025514) is 4-[2-(1-benzyl-4-propan-2-ylcyclohexyl)oxyethyl]morpholine.
What is the SMILES notation for 4-[2-(1-benzyl-4-propan-2-ylcyclohexyl)oxyethyl]morpholine?
The canonical SMILES for 4-[2-(1-benzyl-4-propan-2-ylcyclohexyl)oxyethyl]morpholine is CC(C)C1CCC(Cc2ccccc2)(OCCN2CCOCC2)CC1.
What is the InChIKey of 4-[2-(1-benzyl-4-propan-2-ylcyclohexyl)oxyethyl]morpholine?
The InChIKey is LDHVDQBLHZVPSF-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H35NO2/c1-19(2)21-8-10-22(11-9-21,18-20-6-4-3-5-7-20)25-17-14-23-12-15-24-16-13-23/h3-7,19,21H,8-18H2,1-2H3.
What are the key properties of 4-[2-(1-benzyl-4-propan-2-ylcyclohexyl)oxyethyl]morpholine?
4-[2-(1-benzyl-4-propan-2-ylcyclohexyl)oxyethyl]morpholine has a molecular weight of 345.53 g/mol, XLogP of 4.16, 7 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-(1-benzyl-4-propan-2-ylcyclohexyl)oxyethyl]morpholine is sourced from PubChem (CID 21025514), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).