N-(5-chloro-2-pyridinyl)-4-(6-oxo-3-pyrrolidin-1-ylpyridazin-1-yl)benzamide

C20H18ClN5O2 — CID 50832154

IUPACN-(5-chloro-2-pyridinyl)-4-(6-oxo-3-pyrrolidin-1-ylpyridazin-1-yl)benzamide
SMILESO=C(Nc1ccc(Cl)cn1)c1ccc(-n2nc(N3CCCC3)ccc2=O)cc1
InChIInChI=1S/C20H18ClN5O2/c21-15-5-8-17(22-13-15)23-20(28)14-3-6-16(7-4-14)26-19(27)10-9-18(24-26)25-11-1-2-12-25/h3-10,13H,1-2,11-12H2,(H,22,23,28)
InChIKeyGXLRPRAJDLOLPH-UHFFFAOYSA-N
MW395.85 g/mol
LogP3.13
Rot. Bonds4

About N-(5-chloro-2-pyridinyl)-4-(6-oxo-3-pyrrolidin-1-ylpyridazin-1-yl)benzamide

N-(5-chloro-2-pyridinyl)-4-(6-oxo-3-pyrrolidin-1-ylpyridazin-1-yl)benzamide (PubChem CID 50832154) has the molecular formula C20H18ClN5O2 and a molecular weight of 395.85 g/mol. Its IUPAC name is N-(5-chloro-2-pyridinyl)-4-(6-oxo-3-pyrrolidin-1-ylpyridazin-1-yl)benzamide.

Molecular Properties

Compound NameN-(5-chloro-2-pyridinyl)-4-(6-oxo-3-pyrrolidin-1-ylpyridazin-1-yl)benzamide
PubChem CID50832154
Molecular FormulaC20H18ClN5O2
Molecular Weight395.85 g/mol
Exact Mass395.11
IUPAC NameN-(5-chloro-2-pyridinyl)-4-(6-oxo-3-pyrrolidin-1-ylpyridazin-1-yl)benzamide
SMILESO=C(Nc1ccc(Cl)cn1)c1ccc(-n2nc(N3CCCC3)ccc2=O)cc1
InChIInChI=1S/C20H18ClN5O2/c21-15-5-8-17(22-13-15)23-20(28)14-3-6-16(7-4-14)26-19(27)10-9-18(24-26)25-11-1-2-12-25/h3-10,13H,1-2,11-12H2,(H,22,23,28)
InChIKeyGXLRPRAJDLOLPH-UHFFFAOYSA-N
XLogP3.13
TPSA80.12 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500395.85
LogP ≤ 53.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze N-(5-chloro-2-pyridinyl)-4-(6-oxo-3-pyrrolidin-1-ylpyridazin-1-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-[2-(4-chlorophenyl)ethyl]-4-(6-oxo-3-pyrrolidin-1-ylpyridazin-1-yl)benzamide
CID 50832217
6-pyrrolidin-1-yl-N-(5-pyrrolidin-1-yl-2-pyridinyl)pyridine-3-carboxamide
CID 154735988
N-(3-methoxyphenyl)-4-(6-oxo-3-pyrrolidin-1-ylpyridazin-1-yl)benzamide
CID 50832171
N-(5-chloro-2-pyridinyl)-4-(1,1-dioxo-1,2-thiazolidin-2-yl)benzamide
CID 51250658
4-(6-oxo-3-pyrrolidin-1-ylpyridazin-1-yl)-N-(2-phenylethyl)benzamide
CID 50832290
5-chloro-N-(5-chloro-2-pyridinyl)-2-[[4-(1,4-diazepan-1-yl)benzoyl]amino]benzamide
CID 21075332
4-methyl-N-(5-pyrrolidin-1-yl-2-pyridinyl)benzamide
CID 32947923
2-(4-chlorophenyl)-6-[4-(3,4-diethoxybenzoyl)piperazin-1-yl]pyridazin-3-one
CID 53081894
N-[5-(azepan-1-yl)-2-pyridinyl]-4-methoxybenzamide
CID 39072257
1-[(2-chlorophenyl)methyl]-6-oxo-N-(5-piperidin-1-yl-2-pyridinyl)pyridine-3-carboxamide
CID 112827539
2-(4-chlorophenyl)-6-[4-(3-methylbutanoyl)piperazin-1-yl]pyridazin-3-one
CID 53081890
N-(5-chloro-2-pyridinyl)-4-methyl-3-pyrrolidin-1-ylsulfonylbenzamide
CID 1217132

Frequently Asked Questions

What is the IUPAC name of N-(5-chloro-2-pyridinyl)-4-(6-oxo-3-pyrrolidin-1-ylpyridazin-1-yl)benzamide?
The IUPAC name of N-(5-chloro-2-pyridinyl)-4-(6-oxo-3-pyrrolidin-1-ylpyridazin-1-yl)benzamide (CID 50832154) is N-(5-chloro-2-pyridinyl)-4-(6-oxo-3-pyrrolidin-1-ylpyridazin-1-yl)benzamide.
What is the SMILES notation for N-(5-chloro-2-pyridinyl)-4-(6-oxo-3-pyrrolidin-1-ylpyridazin-1-yl)benzamide?
The canonical SMILES for N-(5-chloro-2-pyridinyl)-4-(6-oxo-3-pyrrolidin-1-ylpyridazin-1-yl)benzamide is O=C(Nc1ccc(Cl)cn1)c1ccc(-n2nc(N3CCCC3)ccc2=O)cc1.
What is the InChIKey of N-(5-chloro-2-pyridinyl)-4-(6-oxo-3-pyrrolidin-1-ylpyridazin-1-yl)benzamide?
The InChIKey is GXLRPRAJDLOLPH-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H18ClN5O2/c21-15-5-8-17(22-13-15)23-20(28)14-3-6-16(7-4-14)26-19(27)10-9-18(24-26)25-11-1-2-12-25/h3-10,13H,1-2,11-12H2,(H,22,23,28).
What are the key properties of N-(5-chloro-2-pyridinyl)-4-(6-oxo-3-pyrrolidin-1-ylpyridazin-1-yl)benzamide?
N-(5-chloro-2-pyridinyl)-4-(6-oxo-3-pyrrolidin-1-ylpyridazin-1-yl)benzamide has a molecular weight of 395.85 g/mol, XLogP of 3.13, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-chloro-2-pyridinyl)-4-(6-oxo-3-pyrrolidin-1-ylpyridazin-1-yl)benzamide is sourced from PubChem (CID 50832154), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).