N-cyclohexyl-N-methyl-4-(6-pyrrolidin-1-ylpyridazin-3-yl)benzamide

C22H28N4O — CID 53035078

IUPACN-cyclohexyl-N-methyl-4-(6-pyrrolidin-1-ylpyridazin-3-yl)benzamide
SMILESCN(C(=O)c1ccc(-c2ccc(N3CCCC3)nn2)cc1)C1CCCCC1
InChIInChI=1S/C22H28N4O/c1-25(19-7-3-2-4-8-19)22(27)18-11-9-17(10-12-18)20-13-14-21(24-23-20)26-15-5-6-16-26/h9-14,19H,2-8,15-16H2,1H3
InChIKeyCMOCEPWOWQMDQR-UHFFFAOYSA-N
MW364.49 g/mol
LogP4.15
Rot. Bonds4

About N-cyclohexyl-N-methyl-4-(6-pyrrolidin-1-ylpyridazin-3-yl)benzamide

N-cyclohexyl-N-methyl-4-(6-pyrrolidin-1-ylpyridazin-3-yl)benzamide (PubChem CID 53035078) has the molecular formula C22H28N4O and a molecular weight of 364.49 g/mol. Its IUPAC name is N-cyclohexyl-N-methyl-4-(6-pyrrolidin-1-ylpyridazin-3-yl)benzamide.

Molecular Properties

Compound NameN-cyclohexyl-N-methyl-4-(6-pyrrolidin-1-ylpyridazin-3-yl)benzamide
PubChem CID53035078
Molecular FormulaC22H28N4O
Molecular Weight364.49 g/mol
Exact Mass364.23
IUPAC NameN-cyclohexyl-N-methyl-4-(6-pyrrolidin-1-ylpyridazin-3-yl)benzamide
SMILESCN(C(=O)c1ccc(-c2ccc(N3CCCC3)nn2)cc1)C1CCCCC1
InChIInChI=1S/C22H28N4O/c1-25(19-7-3-2-4-8-19)22(27)18-11-9-17(10-12-18)20-13-14-21(24-23-20)26-15-5-6-16-26/h9-14,19H,2-8,15-16H2,1H3
InChIKeyCMOCEPWOWQMDQR-UHFFFAOYSA-N
XLogP4.15
TPSA49.33 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500364.49
LogP ≤ 54.15
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze N-cyclohexyl-N-methyl-4-(6-pyrrolidin-1-ylpyridazin-3-yl)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-cyclohexyl-N-methyl-3-(6-morpholin-4-ylpyridazin-3-yl)benzamide
CID 50815959
N-cyclohexyl-N-methyl-2-pyrrolidin-1-ylpyridine-4-carboxamide
CID 84574966
(4-methylpiperidin-1-yl)-[4-(6-pyrrolidin-1-ylpyridazin-3-yl)phenyl]methanone
CID 53035074
N-cyclopentyl-4-(6-pyrrolidin-1-ylpyridazin-3-yl)benzamide
CID 53035075
N-(2-methylpropyl)-4-(6-pyrrolidin-1-ylpyridazin-3-yl)benzamide
CID 53009790
N-propyl-4-(6-pyrrolidin-1-ylpyridazin-3-yl)benzamide
CID 53035071
N-cyclohexyl-4-iodo-N-methylbenzamide
CID 30383969
N-cyclohexyl-4-hydroxy-N-methylbenzamide
CID 43176625
N-(4-methylphenyl)-4-(6-pyrrolidin-1-ylpyridazin-3-yl)benzamide
CID 53098734
N-[4-[6-(azepan-1-yl)pyridazin-3-yl]phenyl]-4-tert-butylbenzamide
CID 43992152
N-cyclopentyl-N-methyl-4-(piperidin-1-ylmethyl)benzamide
CID 46772901
1-(4-methylphenyl)-3-[4-(6-piperidin-1-ylpyridazin-3-yl)phenyl]urea
CID 43992694

Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-N-methyl-4-(6-pyrrolidin-1-ylpyridazin-3-yl)benzamide?
The IUPAC name of N-cyclohexyl-N-methyl-4-(6-pyrrolidin-1-ylpyridazin-3-yl)benzamide (CID 53035078) is N-cyclohexyl-N-methyl-4-(6-pyrrolidin-1-ylpyridazin-3-yl)benzamide.
What is the SMILES notation for N-cyclohexyl-N-methyl-4-(6-pyrrolidin-1-ylpyridazin-3-yl)benzamide?
The canonical SMILES for N-cyclohexyl-N-methyl-4-(6-pyrrolidin-1-ylpyridazin-3-yl)benzamide is CN(C(=O)c1ccc(-c2ccc(N3CCCC3)nn2)cc1)C1CCCCC1.
What is the InChIKey of N-cyclohexyl-N-methyl-4-(6-pyrrolidin-1-ylpyridazin-3-yl)benzamide?
The InChIKey is CMOCEPWOWQMDQR-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H28N4O/c1-25(19-7-3-2-4-8-19)22(27)18-11-9-17(10-12-18)20-13-14-21(24-23-20)26-15-5-6-16-26/h9-14,19H,2-8,15-16H2,1H3.
What are the key properties of N-cyclohexyl-N-methyl-4-(6-pyrrolidin-1-ylpyridazin-3-yl)benzamide?
N-cyclohexyl-N-methyl-4-(6-pyrrolidin-1-ylpyridazin-3-yl)benzamide has a molecular weight of 364.49 g/mol, XLogP of 4.15, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-N-methyl-4-(6-pyrrolidin-1-ylpyridazin-3-yl)benzamide is sourced from PubChem (CID 53035078), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).