3-(1-methyl-6-oxopyridazin-3-yl)-N-[(3R)-3-morpholin-4-ylbutyl]benzamide

C20H26N4O3 — CID 125440311

IUPAC3-(1-methyl-6-oxopyridazin-3-yl)-N-[(3R)-3-morpholin-4-ylbutyl]benzamide
SMILESC[C@H](CCNC(=O)c1cccc(-c2ccc(=O)n(C)n2)c1)N1CCOCC1
InChIInChI=1S/C20H26N4O3/c1-15(24-10-12-27-13-11-24)8-9-21-20(26)17-5-3-4-16(14-17)18-6-7-19(25)23(2)22-18/h3-7,14-15H,8-13H2,1-2H3,(H,21,26)/t15-/m1/s1
InChIKeyREAZTSNHBCYJRT-OAHLLOKOSA-N
MW370.45 g/mol
LogP1.29
Rot. Bonds6

About 3-(1-methyl-6-oxopyridazin-3-yl)-N-[(3R)-3-morpholin-4-ylbutyl]benzamide

3-(1-methyl-6-oxopyridazin-3-yl)-N-[(3R)-3-morpholin-4-ylbutyl]benzamide (PubChem CID 125440311) has the molecular formula C20H26N4O3 and a molecular weight of 370.45 g/mol. Its IUPAC name is 3-(1-methyl-6-oxopyridazin-3-yl)-N-[(3R)-3-morpholin-4-ylbutyl]benzamide.

Molecular Properties

Compound Name3-(1-methyl-6-oxopyridazin-3-yl)-N-[(3R)-3-morpholin-4-ylbutyl]benzamide
PubChem CID125440311
Molecular FormulaC20H26N4O3
Molecular Weight370.45 g/mol
Exact Mass370.20
IUPAC Name3-(1-methyl-6-oxopyridazin-3-yl)-N-[(3R)-3-morpholin-4-ylbutyl]benzamide
SMILESC[C@H](CCNC(=O)c1cccc(-c2ccc(=O)n(C)n2)c1)N1CCOCC1
InChIInChI=1S/C20H26N4O3/c1-15(24-10-12-27-13-11-24)8-9-21-20(26)17-5-3-4-16(14-17)18-6-7-19(25)23(2)22-18/h3-7,14-15H,8-13H2,1-2H3,(H,21,26)/t15-/m1/s1
InChIKeyREAZTSNHBCYJRT-OAHLLOKOSA-N
XLogP1.29
TPSA76.46 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500370.45
LogP ≤ 51.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 3-(1-methyl-6-oxopyridazin-3-yl)-N-[(3R)-3-morpholin-4-ylbutyl]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

3-(5-amino-1-methylpyrazol-4-yl)-N-[(3S)-3-morpholin-4-ylbutyl]benzamide
CID 126447514
3-[4-(methylamino)phenyl]-N-[(3R)-3-morpholin-4-ylbutyl]benzamide
CID 125176405
3-(2-cyanophenyl)-N-[(3R)-3-morpholin-4-ylbutyl]benzamide
CID 126443395
N-(3-morpholin-4-ylbutyl)pyridazine-4-carboxamide
CID 91307914
N-[[1-(3-methoxypropyl)pyrrolidin-3-yl]methyl]-3-(1-methyl-6-oxopyridazin-3-yl)benzamide
CID 122559398
6-[3-(2-morpholin-4-ylethylcarbamoyl)phenyl]pyridine-3-carboxylic acid
CID 121495695
4-(3-cyano-4-fluorophenyl)-N-(3-morpholin-4-ylbutyl)benzamide
CID 121498729
3-(5-methoxy-1-methyl-1,2,4-triazol-3-yl)-N-(3-morpholin-4-ylpropyl)benzamide
CID 118763152
3-(6-morpholin-4-ylpyridazin-3-yl)-N-pentylbenzamide
CID 50816215
5-(5-methylthiophen-2-yl)-N-[(3S)-3-morpholin-4-ylbutyl]-1H-pyrazole-3-carboxamide
CID 164631140
3-(3-ethyl-1-methylpyrazol-4-yl)-N-(2-morpholin-4-ylethyl)benzamide
CID 118781591
3-(3-hydroxy-3-methylbutyl)-N-[(3R)-3-(4-methylpiperazin-1-yl)butyl]benzamide
CID 95872723

Frequently Asked Questions

What is the IUPAC name of 3-(1-methyl-6-oxopyridazin-3-yl)-N-[(3R)-3-morpholin-4-ylbutyl]benzamide?
The IUPAC name of 3-(1-methyl-6-oxopyridazin-3-yl)-N-[(3R)-3-morpholin-4-ylbutyl]benzamide (CID 125440311) is 3-(1-methyl-6-oxopyridazin-3-yl)-N-[(3R)-3-morpholin-4-ylbutyl]benzamide.
What is the SMILES notation for 3-(1-methyl-6-oxopyridazin-3-yl)-N-[(3R)-3-morpholin-4-ylbutyl]benzamide?
The canonical SMILES for 3-(1-methyl-6-oxopyridazin-3-yl)-N-[(3R)-3-morpholin-4-ylbutyl]benzamide is C[C@H](CCNC(=O)c1cccc(-c2ccc(=O)n(C)n2)c1)N1CCOCC1.
What is the InChIKey of 3-(1-methyl-6-oxopyridazin-3-yl)-N-[(3R)-3-morpholin-4-ylbutyl]benzamide?
The InChIKey is REAZTSNHBCYJRT-OAHLLOKOSA-N. The full InChI is InChI=1S/C20H26N4O3/c1-15(24-10-12-27-13-11-24)8-9-21-20(26)17-5-3-4-16(14-17)18-6-7-19(25)23(2)22-18/h3-7,14-15H,8-13H2,1-2H3,(H,21,26)/t15-/m1/s1.
What are the key properties of 3-(1-methyl-6-oxopyridazin-3-yl)-N-[(3R)-3-morpholin-4-ylbutyl]benzamide?
3-(1-methyl-6-oxopyridazin-3-yl)-N-[(3R)-3-morpholin-4-ylbutyl]benzamide has a molecular weight of 370.45 g/mol, XLogP of 1.29, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(1-methyl-6-oxopyridazin-3-yl)-N-[(3R)-3-morpholin-4-ylbutyl]benzamide is sourced from PubChem (CID 125440311), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).