(E)-1-(4-hydroxyphenyl)-5-morpholin-4-ylpent-1-en-3-one

C15H19NO3 — CID 12842145

IUPAC(E)-1-(4-hydroxyphenyl)-5-morpholin-4-ylpent-1-en-3-one
SMILESO=C(/C=C/c1ccc(O)cc1)CCN1CCOCC1
InChIInChI=1S/C15H19NO3/c17-14-4-1-13(2-5-14)3-6-15(18)7-8-16-9-11-19-12-10-16/h1-6,17H,7-12H2/b6-3+
InChIKeyKIVZOFGXFVRLSM-ZZXKWVIFSA-N
MW261.32 g/mol
LogP1.70
Rot. Bonds5

About (E)-1-(4-hydroxyphenyl)-5-morpholin-4-ylpent-1-en-3-one

(E)-1-(4-hydroxyphenyl)-5-morpholin-4-ylpent-1-en-3-one (PubChem CID 12842145) has the molecular formula C15H19NO3 and a molecular weight of 261.32 g/mol. Its IUPAC name is (E)-1-(4-hydroxyphenyl)-5-morpholin-4-ylpent-1-en-3-one.

Molecular Properties

Compound Name(E)-1-(4-hydroxyphenyl)-5-morpholin-4-ylpent-1-en-3-one
PubChem CID12842145
Molecular FormulaC15H19NO3
Molecular Weight261.32 g/mol
Exact Mass261.14
IUPAC Name(E)-1-(4-hydroxyphenyl)-5-morpholin-4-ylpent-1-en-3-one
SMILESO=C(/C=C/c1ccc(O)cc1)CCN1CCOCC1
InChIInChI=1S/C15H19NO3/c17-14-4-1-13(2-5-14)3-6-15(18)7-8-16-9-11-19-12-10-16/h1-6,17H,7-12H2/b6-3+
InChIKeyKIVZOFGXFVRLSM-ZZXKWVIFSA-N
XLogP1.70
TPSA49.77 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.32
LogP ≤ 51.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}

Analyze (E)-1-(4-hydroxyphenyl)-5-morpholin-4-ylpent-1-en-3-one 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-(4-hydroxyphenyl)-5-morpholin-4-ylpent-1-en-3-one;hydrochloride
CID 70534836
(E)-5-[4-[(E)-3-oxo-5-phenylpent-4-enyl]piperazin-1-yl]-1-phenylpent-1-en-3-one;hydrochloride
CID 6518597
1-(2,6-dichlorophenyl)-5-morpholin-4-ylpent-1-en-3-one;hydrochloride
CID 70518223
1,7-bis[4-(2-morpholin-4-ylethoxy)phenyl]hepta-1,6-diene-3,5-dione
CID 123906714
(E)-5-morpholin-4-yl-1-(3-nitrophenyl)pent-1-en-3-one
CID 12842153
ethyl 1-[(E)-5-(4-hydroxyphenyl)-3-oxopent-4-enyl]piperidine-4-carboxylate;hydrochloride
CID 140528482
(E)-1-(4-fluorophenyl)-5-piperidin-1-ylpent-1-en-3-one
CID 59444030
3-morpholin-4-yl-N'-(3-phenylprop-2-enoyl)propanehydrazide;hydrochloride
CID 73242622
(E)-3-[4-(2-morpholin-4-ylethoxy)phenyl]prop-2-enoic acid
CID 18363070
1-(1,3-benzodioxol-2-yl)-5-morpholin-4-ylpent-1-en-3-one
CID 57170741
(Z)-3-[4-(2-morpholin-4-ylethoxy)phenyl]prop-2-enamide
CID 170877328
3-[4-(2-morpholin-4-ylethoxyiminomethyl)phenyl]prop-2-enoic acid
CID 173100165

Frequently Asked Questions

What is the IUPAC name of (E)-1-(4-hydroxyphenyl)-5-morpholin-4-ylpent-1-en-3-one?
The IUPAC name of (E)-1-(4-hydroxyphenyl)-5-morpholin-4-ylpent-1-en-3-one (CID 12842145) is (E)-1-(4-hydroxyphenyl)-5-morpholin-4-ylpent-1-en-3-one.
What is the SMILES notation for (E)-1-(4-hydroxyphenyl)-5-morpholin-4-ylpent-1-en-3-one?
The canonical SMILES for (E)-1-(4-hydroxyphenyl)-5-morpholin-4-ylpent-1-en-3-one is O=C(/C=C/c1ccc(O)cc1)CCN1CCOCC1.
What is the InChIKey of (E)-1-(4-hydroxyphenyl)-5-morpholin-4-ylpent-1-en-3-one?
The InChIKey is KIVZOFGXFVRLSM-ZZXKWVIFSA-N. The full InChI is InChI=1S/C15H19NO3/c17-14-4-1-13(2-5-14)3-6-15(18)7-8-16-9-11-19-12-10-16/h1-6,17H,7-12H2/b6-3+.
What are the key properties of (E)-1-(4-hydroxyphenyl)-5-morpholin-4-ylpent-1-en-3-one?
(E)-1-(4-hydroxyphenyl)-5-morpholin-4-ylpent-1-en-3-one has a molecular weight of 261.32 g/mol, XLogP of 1.70, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-1-(4-hydroxyphenyl)-5-morpholin-4-ylpent-1-en-3-one is sourced from PubChem (CID 12842145), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).