N,N-dimethyl-4-[(4-morpholin-4-ylphenyl)methylideneamino]aniline

C19H23N3O — CID 628093

IUPACN,N-dimethyl-4-[(4-morpholin-4-ylphenyl)methylideneamino]aniline
SMILESCN(C)c1ccc(/N=C/c2ccc(N3CCOCC3)cc2)cc1
InChIInChI=1S/C19H23N3O/c1-21(2)18-9-5-17(6-10-18)20-15-16-3-7-19(8-4-16)22-11-13-23-14-12-22/h3-10,15H,11-14H2,1-2H3/b20-15+
InChIKeyMOQNWJSCPYWTQR-HMMYKYKNSA-N
MW309.41 g/mol
LogP3.34
Rot. Bonds4

About N,N-dimethyl-4-[(4-morpholin-4-ylphenyl)methylideneamino]aniline

N,N-dimethyl-4-[(4-morpholin-4-ylphenyl)methylideneamino]aniline (PubChem CID 628093) has the molecular formula C19H23N3O and a molecular weight of 309.41 g/mol. Its IUPAC name is N,N-dimethyl-4-[(4-morpholin-4-ylphenyl)methylideneamino]aniline.

Molecular Properties

Compound NameN,N-dimethyl-4-[(4-morpholin-4-ylphenyl)methylideneamino]aniline
PubChem CID628093
Molecular FormulaC19H23N3O
Molecular Weight309.41 g/mol
Exact Mass309.18
IUPAC NameN,N-dimethyl-4-[(4-morpholin-4-ylphenyl)methylideneamino]aniline
SMILESCN(C)c1ccc(/N=C/c2ccc(N3CCOCC3)cc2)cc1
InChIInChI=1S/C19H23N3O/c1-21(2)18-9-5-17(6-10-18)20-15-16-3-7-19(8-4-16)22-11-13-23-14-12-22/h3-10,15H,11-14H2,1-2H3/b20-15+
InChIKeyMOQNWJSCPYWTQR-HMMYKYKNSA-N
XLogP3.34
TPSA28.07 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.41
LogP ≤ 53.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_A(478)', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-4-[(4-morpholin-4-ylphenyl)methylideneamino]aniline?
The IUPAC name of N,N-dimethyl-4-[(4-morpholin-4-ylphenyl)methylideneamino]aniline (CID 628093) is N,N-dimethyl-4-[(4-morpholin-4-ylphenyl)methylideneamino]aniline.
What is the SMILES notation for N,N-dimethyl-4-[(4-morpholin-4-ylphenyl)methylideneamino]aniline?
The canonical SMILES for N,N-dimethyl-4-[(4-morpholin-4-ylphenyl)methylideneamino]aniline is CN(C)c1ccc(/N=C/c2ccc(N3CCOCC3)cc2)cc1.
What is the InChIKey of N,N-dimethyl-4-[(4-morpholin-4-ylphenyl)methylideneamino]aniline?
The InChIKey is MOQNWJSCPYWTQR-HMMYKYKNSA-N. The full InChI is InChI=1S/C19H23N3O/c1-21(2)18-9-5-17(6-10-18)20-15-16-3-7-19(8-4-16)22-11-13-23-14-12-22/h3-10,15H,11-14H2,1-2H3/b20-15+.
What are the key properties of N,N-dimethyl-4-[(4-morpholin-4-ylphenyl)methylideneamino]aniline?
N,N-dimethyl-4-[(4-morpholin-4-ylphenyl)methylideneamino]aniline has a molecular weight of 309.41 g/mol, XLogP of 3.34, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-4-[(4-morpholin-4-ylphenyl)methylideneamino]aniline is sourced from PubChem (CID 628093), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).