1-(4-ethylphenyl)-1-(2-methoxyphenyl)-3-morpholin-4-yl-2-phenylpropan-1-ol

C28H33NO3 — CID 4071275

IUPAC1-(4-ethylphenyl)-1-(2-methoxyphenyl)-3-morpholin-4-yl-2-phenylpropan-1-ol
SMILESCCc1ccc(C(O)(c2ccccc2OC)C(CN2CCOCC2)c2ccccc2)cc1
InChIInChI=1S/C28H33NO3/c1-3-22-13-15-24(16-14-22)28(30,25-11-7-8-12-27(25)31-2)26(23-9-5-4-6-10-23)21-29-17-19-32-20-18-29/h4-16,26,30H,3,17-21H2,1-2H3
InChIKeyXPSIKVKQGXEMJM-UHFFFAOYSA-N
MW431.58 g/mol
LogP4.61
Rot. Bonds8

About 1-(4-ethylphenyl)-1-(2-methoxyphenyl)-3-morpholin-4-yl-2-phenylpropan-1-ol

1-(4-ethylphenyl)-1-(2-methoxyphenyl)-3-morpholin-4-yl-2-phenylpropan-1-ol (PubChem CID 4071275) has the molecular formula C28H33NO3 and a molecular weight of 431.58 g/mol. Its IUPAC name is 1-(4-ethylphenyl)-1-(2-methoxyphenyl)-3-morpholin-4-yl-2-phenylpropan-1-ol.

Molecular Properties

Compound Name1-(4-ethylphenyl)-1-(2-methoxyphenyl)-3-morpholin-4-yl-2-phenylpropan-1-ol
PubChem CID4071275
Molecular FormulaC28H33NO3
Molecular Weight431.58 g/mol
Exact Mass431.25
IUPAC Name1-(4-ethylphenyl)-1-(2-methoxyphenyl)-3-morpholin-4-yl-2-phenylpropan-1-ol
SMILESCCc1ccc(C(O)(c2ccccc2OC)C(CN2CCOCC2)c2ccccc2)cc1
InChIInChI=1S/C28H33NO3/c1-3-22-13-15-24(16-14-22)28(30,25-11-7-8-12-27(25)31-2)26(23-9-5-4-6-10-23)21-29-17-19-32-20-18-29/h4-16,26,30H,3,17-21H2,1-2H3
InChIKeyXPSIKVKQGXEMJM-UHFFFAOYSA-N
XLogP4.61
TPSA41.93 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500431.58
LogP ≤ 54.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 1-(4-ethylphenyl)-1-(2-methoxyphenyl)-3-morpholin-4-yl-2-phenylpropan-1-ol 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

Beloxepin
CID 166560
1-((2-Methoxyphenyl)(phenyl)methyl)-4-phenylpiperidin-4-ol
CID 10109899
1-Benzhydryl-4-(2-methoxyphenyl)piperidin-4-ol
CID 44430016
4-[(E)-2-phenyl-1-[4-(2-piperidin-1-ylethoxy)phenyl]prop-1-enyl]phenol
CID 127030255
1-(4-Methoxyphenyl)-3-(morpholin-4-yl)-1-phenylpropan-1-ol
CID 23605688
1-(2-Methoxyphenyl)-3-piperidin-1-yl-1-(4-propoxyphenyl)propan-1-ol
CID 24761187
Co-101244
CID 6918409
2-{3-[4-(2-Benzhydryloxy-ethyl)-piperazin-1-yl]-propyl}-phenol
CID 10598748
(2R,3R,4R,5S)-2-(hydroxymethyl)-1-[5-[[4-(2-methoxyphenyl)phenyl]methoxy]pentyl]piperidine-3,4,5-triol
CID 118411135
3-(4-Methoxyphenyl)-6-methyl-1-morpholin-4-yl-2-phenylheptan-3-ol
CID 24761470
Ro 63-1908
CID 6918426
1-(2-Benzhydryloxy-ethyl)-4-[3-(2-methoxy-phenyl)-propyl]-piperazine
CID 10789465

Frequently Asked Questions

What is the IUPAC name of 1-(4-ethylphenyl)-1-(2-methoxyphenyl)-3-morpholin-4-yl-2-phenylpropan-1-ol?
The IUPAC name of 1-(4-ethylphenyl)-1-(2-methoxyphenyl)-3-morpholin-4-yl-2-phenylpropan-1-ol (CID 4071275) is 1-(4-ethylphenyl)-1-(2-methoxyphenyl)-3-morpholin-4-yl-2-phenylpropan-1-ol.
What is the SMILES notation for 1-(4-ethylphenyl)-1-(2-methoxyphenyl)-3-morpholin-4-yl-2-phenylpropan-1-ol?
The canonical SMILES for 1-(4-ethylphenyl)-1-(2-methoxyphenyl)-3-morpholin-4-yl-2-phenylpropan-1-ol is CCc1ccc(C(O)(c2ccccc2OC)C(CN2CCOCC2)c2ccccc2)cc1.
What is the InChIKey of 1-(4-ethylphenyl)-1-(2-methoxyphenyl)-3-morpholin-4-yl-2-phenylpropan-1-ol?
The InChIKey is XPSIKVKQGXEMJM-UHFFFAOYSA-N. The full InChI is InChI=1S/C28H33NO3/c1-3-22-13-15-24(16-14-22)28(30,25-11-7-8-12-27(25)31-2)26(23-9-5-4-6-10-23)21-29-17-19-32-20-18-29/h4-16,26,30H,3,17-21H2,1-2H3.
What are the key properties of 1-(4-ethylphenyl)-1-(2-methoxyphenyl)-3-morpholin-4-yl-2-phenylpropan-1-ol?
1-(4-ethylphenyl)-1-(2-methoxyphenyl)-3-morpholin-4-yl-2-phenylpropan-1-ol has a molecular weight of 431.58 g/mol, XLogP of 4.61, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-ethylphenyl)-1-(2-methoxyphenyl)-3-morpholin-4-yl-2-phenylpropan-1-ol is sourced from PubChem (CID 4071275), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).