4-ethoxy-N-[4-[(5-morpholin-4-ylpyridazin-3-yl)amino]phenyl]benzamide

C23H25N5O3 — CID 122354914

IUPAC4-ethoxy-N-[4-[(5-morpholin-4-ylpyridazin-3-yl)amino]phenyl]benzamide
SMILESCCOc1ccc(C(=O)Nc2ccc(Nc3cc(N4CCOCC4)cnn3)cc2)cc1
InChIInChI=1S/C23H25N5O3/c1-2-31-21-9-3-17(4-10-21)23(29)26-19-7-5-18(6-8-19)25-22-15-20(16-24-27-22)28-11-13-30-14-12-28/h3-10,15-16H,2,11-14H2,1H3,(H,25,27)(H,26,29)
InChIKeyJDTGRZQQIRTANM-UHFFFAOYSA-N
MW419.49 g/mol
LogP3.71
Rot. Bonds7

About 4-ethoxy-N-[4-[(5-morpholin-4-ylpyridazin-3-yl)amino]phenyl]benzamide

4-ethoxy-N-[4-[(5-morpholin-4-ylpyridazin-3-yl)amino]phenyl]benzamide (PubChem CID 122354914) has the molecular formula C23H25N5O3 and a molecular weight of 419.49 g/mol. Its IUPAC name is 4-ethoxy-N-[4-[(5-morpholin-4-ylpyridazin-3-yl)amino]phenyl]benzamide.

Molecular Properties

Compound Name4-ethoxy-N-[4-[(5-morpholin-4-ylpyridazin-3-yl)amino]phenyl]benzamide
PubChem CID122354914
Molecular FormulaC23H25N5O3
Molecular Weight419.49 g/mol
Exact Mass419.20
IUPAC Name4-ethoxy-N-[4-[(5-morpholin-4-ylpyridazin-3-yl)amino]phenyl]benzamide
SMILESCCOc1ccc(C(=O)Nc2ccc(Nc3cc(N4CCOCC4)cnn3)cc2)cc1
InChIInChI=1S/C23H25N5O3/c1-2-31-21-9-3-17(4-10-21)23(29)26-19-7-5-18(6-8-19)25-22-15-20(16-24-27-22)28-11-13-30-14-12-28/h3-10,15-16H,2,11-14H2,1H3,(H,25,27)(H,26,29)
InChIKeyJDTGRZQQIRTANM-UHFFFAOYSA-N
XLogP3.71
TPSA88.61 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds7
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500419.49
LogP ≤ 53.71
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

Analyze 4-ethoxy-N-[4-[(5-morpholin-4-ylpyridazin-3-yl)amino]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

1-(4-ethoxyphenyl)-3-[4-[(5-morpholin-4-ylpyridazin-3-yl)amino]phenyl]urea
CID 122354979
4-iodo-N-[4-[(5-morpholin-4-ylpyridazin-3-yl)amino]phenyl]benzamide
CID 122355270
3,5-dimethoxy-N-[4-[(5-morpholin-4-ylpyridazin-3-yl)amino]phenyl]benzamide
CID 122354917
1-(4-ethoxyphenyl)-3-[4-[(5-pyrrolidin-1-ylpyridazin-3-yl)amino]phenyl]urea
CID 122354587
1-(4-methoxyphenyl)-3-[4-[(5-morpholin-4-ylpyridazin-3-yl)amino]phenyl]urea
CID 122354960
N-[4-[(5-morpholin-4-ylpyridazin-3-yl)amino]phenyl]butanamide
CID 122354898
2-bromo-5-methoxy-N-[4-[(5-morpholin-4-ylpyridazin-3-yl)amino]phenyl]benzamide
CID 122355154
2,4-dimethyl-N-[4-[(5-morpholin-4-ylpyridazin-3-yl)amino]phenyl]benzamide
CID 122354908
2,5-dimethyl-N-[4-[(5-morpholin-4-ylpyridazin-3-yl)amino]phenyl]furan-3-carboxamide
CID 122355081
N-[4-[(5-morpholin-4-ylpyridazin-3-yl)amino]phenyl]pentanamide
CID 122354899
N-(4-ethoxyphenyl)-6-morpholin-4-ylpyridine-3-carboxamide
CID 17454919
3-(2,5-dimethoxyphenyl)-1-methyl-N-[4-[(5-morpholin-4-ylpyridazin-3-yl)amino]phenyl]pyrazole-5-carboxamide
CID 122355098

Frequently Asked Questions

What is the IUPAC name of 4-ethoxy-N-[4-[(5-morpholin-4-ylpyridazin-3-yl)amino]phenyl]benzamide?
The IUPAC name of 4-ethoxy-N-[4-[(5-morpholin-4-ylpyridazin-3-yl)amino]phenyl]benzamide (CID 122354914) is 4-ethoxy-N-[4-[(5-morpholin-4-ylpyridazin-3-yl)amino]phenyl]benzamide.
What is the SMILES notation for 4-ethoxy-N-[4-[(5-morpholin-4-ylpyridazin-3-yl)amino]phenyl]benzamide?
The canonical SMILES for 4-ethoxy-N-[4-[(5-morpholin-4-ylpyridazin-3-yl)amino]phenyl]benzamide is CCOc1ccc(C(=O)Nc2ccc(Nc3cc(N4CCOCC4)cnn3)cc2)cc1.
What is the InChIKey of 4-ethoxy-N-[4-[(5-morpholin-4-ylpyridazin-3-yl)amino]phenyl]benzamide?
The InChIKey is JDTGRZQQIRTANM-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H25N5O3/c1-2-31-21-9-3-17(4-10-21)23(29)26-19-7-5-18(6-8-19)25-22-15-20(16-24-27-22)28-11-13-30-14-12-28/h3-10,15-16H,2,11-14H2,1H3,(H,25,27)(H,26,29).
What are the key properties of 4-ethoxy-N-[4-[(5-morpholin-4-ylpyridazin-3-yl)amino]phenyl]benzamide?
4-ethoxy-N-[4-[(5-morpholin-4-ylpyridazin-3-yl)amino]phenyl]benzamide has a molecular weight of 419.49 g/mol, XLogP of 3.71, 7 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethoxy-N-[4-[(5-morpholin-4-ylpyridazin-3-yl)amino]phenyl]benzamide is sourced from PubChem (CID 122354914), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).