2,6-dimethyl-4-[(E)-2-(4-morpholin-4-ylphenyl)ethenyl]phenol

C20H23NO2 — CID 164970433

IUPAC2,6-dimethyl-4-[(E)-2-(4-morpholin-4-ylphenyl)ethenyl]phenol
SMILESCc1cc(/C=C/c2ccc(N3CCOCC3)cc2)cc(C)c1O
InChIInChI=1S/C20H23NO2/c1-15-13-18(14-16(2)20(15)22)4-3-17-5-7-19(8-6-17)21-9-11-23-12-10-21/h3-8,13-14,22H,9-12H2,1-2H3/b4-3+
InChIKeySURMUEHUTBUIDA-ONEGZZNKSA-N
MW309.41 g/mol
LogP4.02
Rot. Bonds3

About 2,6-dimethyl-4-[(E)-2-(4-morpholin-4-ylphenyl)ethenyl]phenol

2,6-dimethyl-4-[(E)-2-(4-morpholin-4-ylphenyl)ethenyl]phenol (PubChem CID 164970433) has the molecular formula C20H23NO2 and a molecular weight of 309.41 g/mol. Its IUPAC name is 2,6-dimethyl-4-[(E)-2-(4-morpholin-4-ylphenyl)ethenyl]phenol.

Molecular Properties

Compound Name2,6-dimethyl-4-[(E)-2-(4-morpholin-4-ylphenyl)ethenyl]phenol
PubChem CID164970433
Molecular FormulaC20H23NO2
Molecular Weight309.41 g/mol
Exact Mass309.17
IUPAC Name2,6-dimethyl-4-[(E)-2-(4-morpholin-4-ylphenyl)ethenyl]phenol
SMILESCc1cc(/C=C/c2ccc(N3CCOCC3)cc2)cc(C)c1O
InChIInChI=1S/C20H23NO2/c1-15-13-18(14-16(2)20(15)22)4-3-17-5-7-19(8-6-17)21-9-11-23-12-10-21/h3-8,13-14,22H,9-12H2,1-2H3/b4-3+
InChIKeySURMUEHUTBUIDA-ONEGZZNKSA-N
XLogP4.02
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.41
LogP ≤ 54.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_B(251)', 'substructure': 'N/A'}, {'alert_name': 'stilbene', 'substructure': 'N/A'}

Analyze 2,6-dimethyl-4-[(E)-2-(4-morpholin-4-ylphenyl)ethenyl]phenol 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-[4-[2-(4-morpholin-4-ylphenyl)ethenyl]phenyl]morpholine
CID 141350180
2-fluoro-6-methyl-4-[(E)-2-(4-pyrrolidin-1-ylphenyl)ethenyl]phenol
CID 165080282
2-hydroxy-3-methyl-5-[(E)-2-(4-piperidin-1-ylphenyl)ethenyl]benzaldehyde
CID 159685527
2-hydroxy-3-methoxy-5-[(E)-2-(4-morpholin-4-ylphenyl)ethenyl]benzaldehyde
CID 139552152
4-[2-(4-hydroxy-3,5-dimethylphenyl)ethenyl]-2,6-dimethylphenol
CID 54449458
13-[4-[(E)-2-[4,6-bis[(E)-2-[4-(1,4,7,10-tetraoxa-13-azacyclopentadec-13-yl)phenyl]ethenyl]-1,3,5-triazin-2-yl]ethenyl]phenyl]-1,4,7,10-tetraoxa-13-azacyclopentadecane
CID 132506106
1,5-bis(4-morpholin-4-ylphenyl)penta-1,4-dien-3-one
CID 57031748
ethyl 3-(4-morpholin-4-ylphenyl)prop-2-enoate
CID 134129593
methyl (E)-3-(4-morpholin-4-ylphenyl)prop-2-enoate
CID 91689830
(E)-1-(2,5-dimethylthiophen-3-yl)-3-(4-morpholin-4-ylphenyl)prop-2-en-1-one
CID 8727394
4-[4-(3-bromoprop-1-enyl)phenyl]morpholine
CID 169476236
1-(4-morpholin-4-ylphenyl)-3-[4-[3-(4-morpholin-4-ylphenyl)-3-oxoprop-1-enyl]phenyl]prop-2-en-1-one
CID 171481806

Frequently Asked Questions

What is the IUPAC name of 2,6-dimethyl-4-[(E)-2-(4-morpholin-4-ylphenyl)ethenyl]phenol?
The IUPAC name of 2,6-dimethyl-4-[(E)-2-(4-morpholin-4-ylphenyl)ethenyl]phenol (CID 164970433) is 2,6-dimethyl-4-[(E)-2-(4-morpholin-4-ylphenyl)ethenyl]phenol.
What is the SMILES notation for 2,6-dimethyl-4-[(E)-2-(4-morpholin-4-ylphenyl)ethenyl]phenol?
The canonical SMILES for 2,6-dimethyl-4-[(E)-2-(4-morpholin-4-ylphenyl)ethenyl]phenol is Cc1cc(/C=C/c2ccc(N3CCOCC3)cc2)cc(C)c1O.
What is the InChIKey of 2,6-dimethyl-4-[(E)-2-(4-morpholin-4-ylphenyl)ethenyl]phenol?
The InChIKey is SURMUEHUTBUIDA-ONEGZZNKSA-N. The full InChI is InChI=1S/C20H23NO2/c1-15-13-18(14-16(2)20(15)22)4-3-17-5-7-19(8-6-17)21-9-11-23-12-10-21/h3-8,13-14,22H,9-12H2,1-2H3/b4-3+.
What are the key properties of 2,6-dimethyl-4-[(E)-2-(4-morpholin-4-ylphenyl)ethenyl]phenol?
2,6-dimethyl-4-[(E)-2-(4-morpholin-4-ylphenyl)ethenyl]phenol has a molecular weight of 309.41 g/mol, XLogP of 4.02, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-dimethyl-4-[(E)-2-(4-morpholin-4-ylphenyl)ethenyl]phenol is sourced from PubChem (CID 164970433), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).