2-(2-oxo-2-pyrrolidin-1-ylethyl)-6-(pyrrolidine-1-carbonyl)pyridazin-3-one

C15H20N4O3 — CID 51695245

IUPAC2-(2-oxo-2-pyrrolidin-1-ylethyl)-6-(pyrrolidine-1-carbonyl)pyridazin-3-one
SMILESO=C(Cn1nc(C(=O)N2CCCC2)ccc1=O)N1CCCC1
InChIInChI=1S/C15H20N4O3/c20-13-6-5-12(15(22)18-9-3-4-10-18)16-19(13)11-14(21)17-7-1-2-8-17/h5-6H,1-4,7-11H2
InChIKeyYZSVMQFEWQJPNM-UHFFFAOYSA-N
MW304.35 g/mol
LogP0.10
Rot. Bonds3

About 2-(2-oxo-2-pyrrolidin-1-ylethyl)-6-(pyrrolidine-1-carbonyl)pyridazin-3-one

2-(2-oxo-2-pyrrolidin-1-ylethyl)-6-(pyrrolidine-1-carbonyl)pyridazin-3-one (PubChem CID 51695245) has the molecular formula C15H20N4O3 and a molecular weight of 304.35 g/mol. Its IUPAC name is 2-(2-oxo-2-pyrrolidin-1-ylethyl)-6-(pyrrolidine-1-carbonyl)pyridazin-3-one.

Molecular Properties

Compound Name2-(2-oxo-2-pyrrolidin-1-ylethyl)-6-(pyrrolidine-1-carbonyl)pyridazin-3-one
PubChem CID51695245
Molecular FormulaC15H20N4O3
Molecular Weight304.35 g/mol
Exact Mass304.15
IUPAC Name2-(2-oxo-2-pyrrolidin-1-ylethyl)-6-(pyrrolidine-1-carbonyl)pyridazin-3-one
SMILESO=C(Cn1nc(C(=O)N2CCCC2)ccc1=O)N1CCCC1
InChIInChI=1S/C15H20N4O3/c20-13-6-5-12(15(22)18-9-3-4-10-18)16-19(13)11-14(21)17-7-1-2-8-17/h5-6H,1-4,7-11H2
InChIKeyYZSVMQFEWQJPNM-UHFFFAOYSA-N
XLogP0.10
TPSA75.51 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.35
LogP ≤ 50.10
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

N-Tert-butyl-2-[6-oxo-3-(pyrrolidine-1-carbonyl)-1,6-dihydropyridazin-1-YL]acetamide
CID 51695241
N-Cyclohexyl-N-methyl-2-[6-oxo-3-(pyrrolidine-1-carbonyl)-1,6-dihydropyridazin-1-YL]acetamide
CID 51695246
2-propyl-6-(pyrrolidine-1-carbonyl)pyridazin-3(2H)-one
CID 42162063
2-Methyl-6-(pyrrolidine-1-carbonyl)-2,3-dihydropyridazin-3-one
CID 42443196
2-ethyl-6-(pyrrolidine-1-carbonyl)pyridazin-3(2H)-one
CID 44012346
2-isopropyl-6-(pyrrolidine-1-carbonyl)pyridazin-3(2H)-one
CID 44012513
2-Butyl-6-(pyrrolidine-1-carbonyl)-2,3-dihydropyridazin-3-one
CID 44012837
N,N-dimethyl-1-(6-oxo-1-propylpyridazine-3-carbonyl)pyrrolidine-2-carboxamide
CID 47020108
6-methyl-2-(1-oxo-1-(pyrrolidin-1-yl)propan-2-yl)pyridazin-3(2H)-one
CID 49704621
N-Butyl-2-[6-oxo-3-(pyrrolidine-1-carbonyl)-1,6-dihydropyridazin-1-YL]acetamide
CID 52118374
N-[(2R)-butan-2-yl]-2-[6-oxo-3-(pyrrolidine-1-carbonyl)pyridazin-1-yl]acetamide
CID 52118399
N-[(2S)-butan-2-yl]-2-[6-oxo-3-(pyrrolidine-1-carbonyl)pyridazin-1-yl]acetamide
CID 52118400

Frequently Asked Questions

What is the IUPAC name of 2-(2-oxo-2-pyrrolidin-1-ylethyl)-6-(pyrrolidine-1-carbonyl)pyridazin-3-one?
The IUPAC name of 2-(2-oxo-2-pyrrolidin-1-ylethyl)-6-(pyrrolidine-1-carbonyl)pyridazin-3-one (CID 51695245) is 2-(2-oxo-2-pyrrolidin-1-ylethyl)-6-(pyrrolidine-1-carbonyl)pyridazin-3-one.
What is the SMILES notation for 2-(2-oxo-2-pyrrolidin-1-ylethyl)-6-(pyrrolidine-1-carbonyl)pyridazin-3-one?
The canonical SMILES for 2-(2-oxo-2-pyrrolidin-1-ylethyl)-6-(pyrrolidine-1-carbonyl)pyridazin-3-one is O=C(Cn1nc(C(=O)N2CCCC2)ccc1=O)N1CCCC1.
What is the InChIKey of 2-(2-oxo-2-pyrrolidin-1-ylethyl)-6-(pyrrolidine-1-carbonyl)pyridazin-3-one?
The InChIKey is YZSVMQFEWQJPNM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N4O3/c20-13-6-5-12(15(22)18-9-3-4-10-18)16-19(13)11-14(21)17-7-1-2-8-17/h5-6H,1-4,7-11H2.
What are the key properties of 2-(2-oxo-2-pyrrolidin-1-ylethyl)-6-(pyrrolidine-1-carbonyl)pyridazin-3-one?
2-(2-oxo-2-pyrrolidin-1-ylethyl)-6-(pyrrolidine-1-carbonyl)pyridazin-3-one has a molecular weight of 304.35 g/mol, XLogP of 0.10, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-oxo-2-pyrrolidin-1-ylethyl)-6-(pyrrolidine-1-carbonyl)pyridazin-3-one is sourced from PubChem (CID 51695245), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).