4-morpholin-4-yl-N-[4-[4-[(4-morpholin-4-ylbenzoyl)amino]anilino]phenyl]benzamide

C34H35N5O4 — CID 67686927

IUPAC4-morpholin-4-yl-N-[4-[4-[(4-morpholin-4-ylbenzoyl)amino]anilino]phenyl]benzamide
SMILESO=C(Nc1ccc(Nc2ccc(NC(=O)c3ccc(N4CCOCC4)cc3)cc2)cc1)c1ccc(N2CCOCC2)cc1
InChIInChI=1S/C34H35N5O4/c40-33(25-1-13-31(14-2-25)38-17-21-42-22-18-38)36-29-9-5-27(6-10-29)35-28-7-11-30(12-8-28)37-34(41)26-3-15-32(16-4-26)39-19-23-43-24-20-39/h1-16,35H,17-24H2,(H,36,40)(H,37,41)
InChIKeyAVSNZXNYPKEMNH-UHFFFAOYSA-N
MW577.69 g/mol
LogP5.61
Rot. Bonds8

About 4-morpholin-4-yl-N-[4-[4-[(4-morpholin-4-ylbenzoyl)amino]anilino]phenyl]benzamide

4-morpholin-4-yl-N-[4-[4-[(4-morpholin-4-ylbenzoyl)amino]anilino]phenyl]benzamide (PubChem CID 67686927) has the molecular formula C34H35N5O4 and a molecular weight of 577.69 g/mol. Its IUPAC name is 4-morpholin-4-yl-N-[4-[4-[(4-morpholin-4-ylbenzoyl)amino]anilino]phenyl]benzamide.

Molecular Properties

Compound Name4-morpholin-4-yl-N-[4-[4-[(4-morpholin-4-ylbenzoyl)amino]anilino]phenyl]benzamide
PubChem CID67686927
Molecular FormulaC34H35N5O4
Molecular Weight577.69 g/mol
Exact Mass577.27
IUPAC Name4-morpholin-4-yl-N-[4-[4-[(4-morpholin-4-ylbenzoyl)amino]anilino]phenyl]benzamide
SMILESO=C(Nc1ccc(Nc2ccc(NC(=O)c3ccc(N4CCOCC4)cc3)cc2)cc1)c1ccc(N2CCOCC2)cc1
InChIInChI=1S/C34H35N5O4/c40-33(25-1-13-31(14-2-25)38-17-21-42-22-18-38)36-29-9-5-27(6-10-29)35-28-7-11-30(12-8-28)37-34(41)26-3-15-32(16-4-26)39-19-23-43-24-20-39/h1-16,35H,17-24H2,(H,36,40)(H,37,41)
InChIKeyAVSNZXNYPKEMNH-UHFFFAOYSA-N
XLogP5.61
TPSA95.17 Ų
H-Bond Donors3
H-Bond Acceptors7
Rotatable Bonds8
Heavy Atoms43
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500577.69
LogP ≤ 55.61
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 107

Analyze 4-morpholin-4-yl-N-[4-[4-[(4-morpholin-4-ylbenzoyl)amino]anilino]phenyl]benzamide 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

N-[4-[4-[(4-morpholin-4-ylbenzoyl)amino]anilino]phenyl]-4-piperazin-1-ylbenzamide
CID 67112495
4-acetyl-N-(4-morpholin-4-ylphenyl)benzamide
CID 803418
N,N-dimethyl-4-[(4-morpholin-4-ylbenzoyl)amino]benzamide
CID 70703870
2-methyl-3-[4-[(4-morpholin-4-ylbenzoyl)amino]phenyl]propanoic acid
CID 120541058
4-fluoro-N-[4-(4-pyrrolidin-1-ylanilino)phenyl]benzamide
CID 112988761
N-[4-(4-pyrrolidin-1-ylanilino)phenyl]benzamide
CID 112988758
2-[2-[[4-[(4-morpholin-4-ylphenyl)carbamoyl]phenyl]carbamoyl]phenyl]benzoic acid
CID 24984100
4-morpholin-4-yl-N-[4-[4-(propylamino)benzoyl]phenyl]benzamide
CID 67112698
N-(4-morpholin-4-ylphenyl)-4-[(6-phenylpyridazin-3-yl)amino]benzamide
CID 50776985
3-fluoro-4-methyl-N-(4-morpholin-4-ylphenyl)benzamide
CID 17467075
4-morpholin-4-yl-N-[4-(phenylsulfamoyl)phenyl]benzamide
CID 21173992
N-[4-(4-aminoanilino)phenyl]-4-(4-hydroxypiperidin-1-yl)benzamide
CID 67112995

Frequently Asked Questions

What is the IUPAC name of 4-morpholin-4-yl-N-[4-[4-[(4-morpholin-4-ylbenzoyl)amino]anilino]phenyl]benzamide?
The IUPAC name of 4-morpholin-4-yl-N-[4-[4-[(4-morpholin-4-ylbenzoyl)amino]anilino]phenyl]benzamide (CID 67686927) is 4-morpholin-4-yl-N-[4-[4-[(4-morpholin-4-ylbenzoyl)amino]anilino]phenyl]benzamide.
What is the SMILES notation for 4-morpholin-4-yl-N-[4-[4-[(4-morpholin-4-ylbenzoyl)amino]anilino]phenyl]benzamide?
The canonical SMILES for 4-morpholin-4-yl-N-[4-[4-[(4-morpholin-4-ylbenzoyl)amino]anilino]phenyl]benzamide is O=C(Nc1ccc(Nc2ccc(NC(=O)c3ccc(N4CCOCC4)cc3)cc2)cc1)c1ccc(N2CCOCC2)cc1.
What is the InChIKey of 4-morpholin-4-yl-N-[4-[4-[(4-morpholin-4-ylbenzoyl)amino]anilino]phenyl]benzamide?
The InChIKey is AVSNZXNYPKEMNH-UHFFFAOYSA-N. The full InChI is InChI=1S/C34H35N5O4/c40-33(25-1-13-31(14-2-25)38-17-21-42-22-18-38)36-29-9-5-27(6-10-29)35-28-7-11-30(12-8-28)37-34(41)26-3-15-32(16-4-26)39-19-23-43-24-20-39/h1-16,35H,17-24H2,(H,36,40)(H,37,41).
What are the key properties of 4-morpholin-4-yl-N-[4-[4-[(4-morpholin-4-ylbenzoyl)amino]anilino]phenyl]benzamide?
4-morpholin-4-yl-N-[4-[4-[(4-morpholin-4-ylbenzoyl)amino]anilino]phenyl]benzamide has a molecular weight of 577.69 g/mol, XLogP of 5.61, 8 rotatable bonds, 3 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 4-morpholin-4-yl-N-[4-[4-[(4-morpholin-4-ylbenzoyl)amino]anilino]phenyl]benzamide is sourced from PubChem (CID 67686927), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).