N-(6-methylpyridazin-3-yl)-4-[(2-propyl-2,5-dihydropyrrol-1-yl)methyl]benzamide

C20H24N4O — CID 50960208

IUPACN-(6-methylpyridazin-3-yl)-4-[(2-propyl-2,5-dihydropyrrol-1-yl)methyl]benzamide
SMILESCCCC1C=CCN1Cc1ccc(C(=O)Nc2ccc(C)nn2)cc1
InChIInChI=1S/C20H24N4O/c1-3-5-18-6-4-13-24(18)14-16-8-10-17(11-9-16)20(25)21-19-12-7-15(2)22-23-19/h4,6-12,18H,3,5,13-14H2,1-2H3,(H,21,23,25)
InChIKeyWQYLGMUUUYYYKS-UHFFFAOYSA-N
MW336.44 g/mol
LogP3.58
Rot. Bonds6

About N-(6-methylpyridazin-3-yl)-4-[(2-propyl-2,5-dihydropyrrol-1-yl)methyl]benzamide

N-(6-methylpyridazin-3-yl)-4-[(2-propyl-2,5-dihydropyrrol-1-yl)methyl]benzamide (PubChem CID 50960208) has the molecular formula C20H24N4O and a molecular weight of 336.44 g/mol. Its IUPAC name is N-(6-methylpyridazin-3-yl)-4-[(2-propyl-2,5-dihydropyrrol-1-yl)methyl]benzamide.

Molecular Properties

Compound NameN-(6-methylpyridazin-3-yl)-4-[(2-propyl-2,5-dihydropyrrol-1-yl)methyl]benzamide
PubChem CID50960208
Molecular FormulaC20H24N4O
Molecular Weight336.44 g/mol
Exact Mass336.20
IUPAC NameN-(6-methylpyridazin-3-yl)-4-[(2-propyl-2,5-dihydropyrrol-1-yl)methyl]benzamide
SMILESCCCC1C=CCN1Cc1ccc(C(=O)Nc2ccc(C)nn2)cc1
InChIInChI=1S/C20H24N4O/c1-3-5-18-6-4-13-24(18)14-16-8-10-17(11-9-16)20(25)21-19-12-7-15(2)22-23-19/h4,6-12,18H,3,5,13-14H2,1-2H3,(H,21,23,25)
InChIKeyWQYLGMUUUYYYKS-UHFFFAOYSA-N
XLogP3.58
TPSA58.12 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500336.44
LogP ≤ 53.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

Analyze N-(6-methylpyridazin-3-yl)-4-[(2-propyl-2,5-dihydropyrrol-1-yl)methyl]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-acetamidophenyl)-4-[[(2S)-2-ethyl-2,5-dihydropyrrol-1-yl]methyl]benzamide
CID 95144206
N-(6-methylpyridazin-3-yl)-3-[[(3S)-3-propylmorpholin-4-yl]methyl]benzamide
CID 95219056
4-methyl-N-[6-[(4-methylphenyl)methylamino]pyridazin-3-yl]benzamide
CID 113041076
2-chloro-N-(6-methylpyridazin-3-yl)acetamide
CID 166407156
4-[(6-propyl-3,6-dihydro-2H-pyridin-1-yl)methyl]phenol
CID 22393845
N-(6-chloropyridazin-3-yl)-4-(methylsulfonylmethyl)benzamide
CID 56805495
4-butoxy-N-(6-chloropyridazin-3-yl)benzamide
CID 115608608
N-[6-(cyclopropylamino)pyridazin-3-yl]-4-methylbenzamide
CID 113038053
N-(6-chloropyridazin-3-yl)-3-ethyl-6-methylpyridazine-4-carboxamide
CID 104624330
2-[[4-(azetidin-1-ylmethyl)benzoyl]amino]-5-methyl-N-(5-methyl-2-pyridinyl)benzamide
CID 70883763
4-chloro-N-[6-[2-(dimethylamino)ethylamino]pyridazin-3-yl]benzamide
CID 113039930
4-methoxy-N-[6-[(4-methoxyphenyl)methylamino]pyridazin-3-yl]benzamide
CID 113041761

Frequently Asked Questions

What is the IUPAC name of N-(6-methylpyridazin-3-yl)-4-[(2-propyl-2,5-dihydropyrrol-1-yl)methyl]benzamide?
The IUPAC name of N-(6-methylpyridazin-3-yl)-4-[(2-propyl-2,5-dihydropyrrol-1-yl)methyl]benzamide (CID 50960208) is N-(6-methylpyridazin-3-yl)-4-[(2-propyl-2,5-dihydropyrrol-1-yl)methyl]benzamide.
What is the SMILES notation for N-(6-methylpyridazin-3-yl)-4-[(2-propyl-2,5-dihydropyrrol-1-yl)methyl]benzamide?
The canonical SMILES for N-(6-methylpyridazin-3-yl)-4-[(2-propyl-2,5-dihydropyrrol-1-yl)methyl]benzamide is CCCC1C=CCN1Cc1ccc(C(=O)Nc2ccc(C)nn2)cc1.
What is the InChIKey of N-(6-methylpyridazin-3-yl)-4-[(2-propyl-2,5-dihydropyrrol-1-yl)methyl]benzamide?
The InChIKey is WQYLGMUUUYYYKS-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24N4O/c1-3-5-18-6-4-13-24(18)14-16-8-10-17(11-9-16)20(25)21-19-12-7-15(2)22-23-19/h4,6-12,18H,3,5,13-14H2,1-2H3,(H,21,23,25).
What are the key properties of N-(6-methylpyridazin-3-yl)-4-[(2-propyl-2,5-dihydropyrrol-1-yl)methyl]benzamide?
N-(6-methylpyridazin-3-yl)-4-[(2-propyl-2,5-dihydropyrrol-1-yl)methyl]benzamide has a molecular weight of 336.44 g/mol, XLogP of 3.58, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(6-methylpyridazin-3-yl)-4-[(2-propyl-2,5-dihydropyrrol-1-yl)methyl]benzamide is sourced from PubChem (CID 50960208), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).