4-[3-[2-(2-methylpropoxy)phenyl]propyl]morpholine

C17H27NO2 — CID 170870421

IUPAC4-[3-[2-(2-methylpropoxy)phenyl]propyl]morpholine
SMILESCC(C)COc1ccccc1CCCN1CCOCC1
InChIInChI=1S/C17H27NO2/c1-15(2)14-20-17-8-4-3-6-16(17)7-5-9-18-10-12-19-13-11-18/h3-4,6,8,15H,5,7,9-14H2,1-2H3
InChIKeyFESFOKVTFAESIN-UHFFFAOYSA-N
MW277.41 g/mol
LogP2.99
Rot. Bonds7

About 4-[3-[2-(2-methylpropoxy)phenyl]propyl]morpholine

4-[3-[2-(2-methylpropoxy)phenyl]propyl]morpholine (PubChem CID 170870421) has the molecular formula C17H27NO2 and a molecular weight of 277.41 g/mol. Its IUPAC name is 4-[3-[2-(2-methylpropoxy)phenyl]propyl]morpholine.

Molecular Properties

Compound Name4-[3-[2-(2-methylpropoxy)phenyl]propyl]morpholine
PubChem CID170870421
Molecular FormulaC17H27NO2
Molecular Weight277.41 g/mol
Exact Mass277.20
IUPAC Name4-[3-[2-(2-methylpropoxy)phenyl]propyl]morpholine
SMILESCC(C)COc1ccccc1CCCN1CCOCC1
InChIInChI=1S/C17H27NO2/c1-15(2)14-20-17-8-4-3-6-16(17)7-5-9-18-10-12-19-13-11-18/h3-4,6,8,15H,5,7,9-14H2,1-2H3
InChIKeyFESFOKVTFAESIN-UHFFFAOYSA-N
XLogP2.99
TPSA21.70 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.41
LogP ≤ 52.99
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 4-[3-[2-(2-methylpropoxy)phenyl]propyl]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

4-[3-[2-(3-morpholin-4-ylpropoxy)phenyl]propyl]morpholine
CID 170869645
4-[3-(2-phenylmethoxyphenyl)propyl]morpholine
CID 170869183
3-[2-(3-morpholin-4-ylpropyl)phenoxy]propyl-triphenylphosphanium
CID 170869428
2-[[2-(2-methylpropoxy)phenyl]methyl]-1-(3-morpholin-4-ylpropyl)guanidine
CID 111074543
4-[3-[2-(2-methyl-5-propan-2-ylphenoxy)phenyl]propyl]morpholine
CID 170870671
4-[2-[2-(4-phenylbutyl)phenoxy]ethyl]morpholine
CID 15389030
4-[3-[2-[(3-chlorophenyl)methoxy]phenyl]propyl]morpholine
CID 170870365
2-[2-(2-morpholin-4-ylethoxy)phenyl]ethanol
CID 107713272
4-[3-[2-[4-[2-(3-morpholin-4-ylpropyl)phenyl]piperazin-1-yl]phenyl]propyl]morpholine
CID 170869798
4-[3-[3-(3-morpholin-4-ylpropyl)naphthalen-2-yl]propyl]morpholine
CID 170869299
1-methyl-4-[3-[2-(oxan-4-yloxy)phenyl]propyl]piperazine
CID 170863354
1-[3-[5-bromo-2-(2-methylpropoxy)phenyl]propyl]-4-methylpiperazine
CID 170863712

Frequently Asked Questions

What is the IUPAC name of 4-[3-[2-(2-methylpropoxy)phenyl]propyl]morpholine?
The IUPAC name of 4-[3-[2-(2-methylpropoxy)phenyl]propyl]morpholine (CID 170870421) is 4-[3-[2-(2-methylpropoxy)phenyl]propyl]morpholine.
What is the SMILES notation for 4-[3-[2-(2-methylpropoxy)phenyl]propyl]morpholine?
The canonical SMILES for 4-[3-[2-(2-methylpropoxy)phenyl]propyl]morpholine is CC(C)COc1ccccc1CCCN1CCOCC1.
What is the InChIKey of 4-[3-[2-(2-methylpropoxy)phenyl]propyl]morpholine?
The InChIKey is FESFOKVTFAESIN-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H27NO2/c1-15(2)14-20-17-8-4-3-6-16(17)7-5-9-18-10-12-19-13-11-18/h3-4,6,8,15H,5,7,9-14H2,1-2H3.
What are the key properties of 4-[3-[2-(2-methylpropoxy)phenyl]propyl]morpholine?
4-[3-[2-(2-methylpropoxy)phenyl]propyl]morpholine has a molecular weight of 277.41 g/mol, XLogP of 2.99, 7 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[3-[2-(2-methylpropoxy)phenyl]propyl]morpholine is sourced from PubChem (CID 170870421), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).