2,4-dichloro-3-methyl-6-[(2-morpholin-4-ylphenyl)methylamino]phenol

C18H20Cl2N2O2 — CID 87654793

IUPAC2,4-dichloro-3-methyl-6-[(2-morpholin-4-ylphenyl)methylamino]phenol
SMILESCc1c(Cl)cc(NCc2ccccc2N2CCOCC2)c(O)c1Cl
InChIInChI=1S/C18H20Cl2N2O2/c1-12-14(19)10-15(18(23)17(12)20)21-11-13-4-2-3-5-16(13)22-6-8-24-9-7-22/h2-5,10,21,23H,6-9,11H2,1H3
InChIKeyUGZTXSDETAQHFZ-UHFFFAOYSA-N
MW367.28 g/mol
LogP4.46
Rot. Bonds4

About 2,4-dichloro-3-methyl-6-[(2-morpholin-4-ylphenyl)methylamino]phenol

2,4-dichloro-3-methyl-6-[(2-morpholin-4-ylphenyl)methylamino]phenol (PubChem CID 87654793) has the molecular formula C18H20Cl2N2O2 and a molecular weight of 367.28 g/mol. Its IUPAC name is 2,4-dichloro-3-methyl-6-[(2-morpholin-4-ylphenyl)methylamino]phenol.

Molecular Properties

Compound Name2,4-dichloro-3-methyl-6-[(2-morpholin-4-ylphenyl)methylamino]phenol
PubChem CID87654793
Molecular FormulaC18H20Cl2N2O2
Molecular Weight367.28 g/mol
Exact Mass366.09
IUPAC Name2,4-dichloro-3-methyl-6-[(2-morpholin-4-ylphenyl)methylamino]phenol
SMILESCc1c(Cl)cc(NCc2ccccc2N2CCOCC2)c(O)c1Cl
InChIInChI=1S/C18H20Cl2N2O2/c1-12-14(19)10-15(18(23)17(12)20)21-11-13-4-2-3-5-16(13)22-6-8-24-9-7-22/h2-5,10,21,23H,6-9,11H2,1H3
InChIKeyUGZTXSDETAQHFZ-UHFFFAOYSA-N
XLogP4.46
TPSA44.73 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500367.28
LogP ≤ 54.46
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze 2,4-dichloro-3-methyl-6-[(2-morpholin-4-ylphenyl)methylamino]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

2-chloro-4-[(2-morpholin-4-ylphenyl)methylamino]benzonitrile
CID 133299332
3-chloro-N-[(2-chlorophenyl)methyl]-4-morpholin-4-ylaniline
CID 18778325
2-chloro-N-[(2-piperidin-1-ylphenyl)methyl]aniline
CID 102141115
2-methyl-N-[(2-morpholin-4-ylphenyl)methyl]propanamide
CID 47400471
2,4-dichloro-N-[(2-pyrrolidin-1-ylphenyl)methyl]aniline
CID 43758691
3,3-dimethyl-1-[(2-morpholin-4-ylphenyl)methylamino]butan-2-ol
CID 111119117
4-[2-(2,2-dimethylpropyl)phenyl]morpholine
CID 58063137
4-[(2-morpholin-4-ylphenyl)methylamino]cyclohexan-1-ol
CID 110928598
5,6-dimethyl-3-[(2-morpholin-4-ylphenyl)methylamino]pyridazine-4-carbonitrile
CID 56821491
N-(2-chlorophenyl)-2-(2-morpholin-4-ylanilino)acetamide
CID 109008426
N-[(2-morpholin-4-ylphenyl)methyl]-1H-benzimidazol-2-amine
CID 133409906
2-methyl-1-[(2-morpholin-4-ylphenyl)methyl]guanidine;hydroiodide
CID 75419013

Frequently Asked Questions

What is the IUPAC name of 2,4-dichloro-3-methyl-6-[(2-morpholin-4-ylphenyl)methylamino]phenol?
The IUPAC name of 2,4-dichloro-3-methyl-6-[(2-morpholin-4-ylphenyl)methylamino]phenol (CID 87654793) is 2,4-dichloro-3-methyl-6-[(2-morpholin-4-ylphenyl)methylamino]phenol.
What is the SMILES notation for 2,4-dichloro-3-methyl-6-[(2-morpholin-4-ylphenyl)methylamino]phenol?
The canonical SMILES for 2,4-dichloro-3-methyl-6-[(2-morpholin-4-ylphenyl)methylamino]phenol is Cc1c(Cl)cc(NCc2ccccc2N2CCOCC2)c(O)c1Cl.
What is the InChIKey of 2,4-dichloro-3-methyl-6-[(2-morpholin-4-ylphenyl)methylamino]phenol?
The InChIKey is UGZTXSDETAQHFZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20Cl2N2O2/c1-12-14(19)10-15(18(23)17(12)20)21-11-13-4-2-3-5-16(13)22-6-8-24-9-7-22/h2-5,10,21,23H,6-9,11H2,1H3.
What are the key properties of 2,4-dichloro-3-methyl-6-[(2-morpholin-4-ylphenyl)methylamino]phenol?
2,4-dichloro-3-methyl-6-[(2-morpholin-4-ylphenyl)methylamino]phenol has a molecular weight of 367.28 g/mol, XLogP of 4.46, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-dichloro-3-methyl-6-[(2-morpholin-4-ylphenyl)methylamino]phenol is sourced from PubChem (CID 87654793), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).