N-cyclohexyl-N-methyl-3-(6-morpholin-4-ylpyridazin-3-yl)benzamide

C22H28N4O2 — CID 50815959

IUPACN-cyclohexyl-N-methyl-3-(6-morpholin-4-ylpyridazin-3-yl)benzamide
SMILESCN(C(=O)c1cccc(-c2ccc(N3CCOCC3)nn2)c1)C1CCCCC1
InChIInChI=1S/C22H28N4O2/c1-25(19-8-3-2-4-9-19)22(27)18-7-5-6-17(16-18)20-10-11-21(24-23-20)26-12-14-28-15-13-26/h5-7,10-11,16,19H,2-4,8-9,12-15H2,1H3
InChIKeyXVSMVEATZIDVGT-UHFFFAOYSA-N
MW380.49 g/mol
LogP3.38
Rot. Bonds4

About N-cyclohexyl-N-methyl-3-(6-morpholin-4-ylpyridazin-3-yl)benzamide

N-cyclohexyl-N-methyl-3-(6-morpholin-4-ylpyridazin-3-yl)benzamide (PubChem CID 50815959) has the molecular formula C22H28N4O2 and a molecular weight of 380.49 g/mol. Its IUPAC name is N-cyclohexyl-N-methyl-3-(6-morpholin-4-ylpyridazin-3-yl)benzamide.

Molecular Properties

Compound NameN-cyclohexyl-N-methyl-3-(6-morpholin-4-ylpyridazin-3-yl)benzamide
PubChem CID50815959
Molecular FormulaC22H28N4O2
Molecular Weight380.49 g/mol
Exact Mass380.22
IUPAC NameN-cyclohexyl-N-methyl-3-(6-morpholin-4-ylpyridazin-3-yl)benzamide
SMILESCN(C(=O)c1cccc(-c2ccc(N3CCOCC3)nn2)c1)C1CCCCC1
InChIInChI=1S/C22H28N4O2/c1-25(19-8-3-2-4-9-19)22(27)18-7-5-6-17(16-18)20-10-11-21(24-23-20)26-12-14-28-15-13-26/h5-7,10-11,16,19H,2-4,8-9,12-15H2,1H3
InChIKeyXVSMVEATZIDVGT-UHFFFAOYSA-N
XLogP3.38
TPSA58.56 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500380.49
LogP ≤ 53.38
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

N-cyclohexyl-N-methyl-4-(6-pyrrolidin-1-ylpyridazin-3-yl)benzamide
CID 53035078
3-(6-morpholin-4-ylpyridazin-3-yl)-N-pentylbenzamide
CID 50816215
N-cyclopentyl-N-methyl-4-morpholin-4-ylbenzamide
CID 43910092
N-cyclooctyl-N-methyl-3-morpholin-4-ylsulfonylbenzamide
CID 60610211
N-[3-(6-morpholin-4-ylpyridazin-3-yl)phenyl]benzamide
CID 7422444
N-cyclohexyl-N-methyl-2-pyrrolidin-1-ylpyridine-4-carboxamide
CID 84574966
N-[(4-bromophenyl)methyl]-3-(6-morpholin-4-ylpyridazin-3-yl)benzamide
CID 50815991
N-(4-chlorophenyl)-3-(6-morpholin-4-ylpyridazin-3-yl)benzamide
CID 50815960
N-cyclopentyl-3-hydroxy-N-methylbenzamide
CID 43243153
3-(6-morpholin-4-ylpyridazin-3-yl)-N-(3-phenylpropyl)benzamide
CID 50816070
N-cyclohexyl-N-methyl-4-morpholin-4-yl-3-nitrobenzamide
CID 2969969
N-[2-(cyclohexen-1-yl)ethyl]-3-(6-morpholin-4-ylpyridazin-3-yl)benzamide
CID 46375087

Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-N-methyl-3-(6-morpholin-4-ylpyridazin-3-yl)benzamide?
The IUPAC name of N-cyclohexyl-N-methyl-3-(6-morpholin-4-ylpyridazin-3-yl)benzamide (CID 50815959) is N-cyclohexyl-N-methyl-3-(6-morpholin-4-ylpyridazin-3-yl)benzamide.
What is the SMILES notation for N-cyclohexyl-N-methyl-3-(6-morpholin-4-ylpyridazin-3-yl)benzamide?
The canonical SMILES for N-cyclohexyl-N-methyl-3-(6-morpholin-4-ylpyridazin-3-yl)benzamide is CN(C(=O)c1cccc(-c2ccc(N3CCOCC3)nn2)c1)C1CCCCC1.
What is the InChIKey of N-cyclohexyl-N-methyl-3-(6-morpholin-4-ylpyridazin-3-yl)benzamide?
The InChIKey is XVSMVEATZIDVGT-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H28N4O2/c1-25(19-8-3-2-4-9-19)22(27)18-7-5-6-17(16-18)20-10-11-21(24-23-20)26-12-14-28-15-13-26/h5-7,10-11,16,19H,2-4,8-9,12-15H2,1H3.
What are the key properties of N-cyclohexyl-N-methyl-3-(6-morpholin-4-ylpyridazin-3-yl)benzamide?
N-cyclohexyl-N-methyl-3-(6-morpholin-4-ylpyridazin-3-yl)benzamide has a molecular weight of 380.49 g/mol, XLogP of 3.38, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-N-methyl-3-(6-morpholin-4-ylpyridazin-3-yl)benzamide is sourced from PubChem (CID 50815959), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).