2-[2-(diethylamino)ethyl]-5-(propylamino)pyridazin-3-one

C13H24N4O — CID 103220143

IUPAC2-[2-(diethylamino)ethyl]-5-(propylamino)pyridazin-3-one
SMILESCCCNc1cnn(CCN(CC)CC)c(=O)c1
InChIInChI=1S/C13H24N4O/c1-4-7-14-12-10-13(18)17(15-11-12)9-8-16(5-2)6-3/h10-11,14H,4-9H2,1-3H3
InChIKeyYUGCGZGVLCWRRY-UHFFFAOYSA-N
MW252.36 g/mol
LogP1.41
Rot. Bonds8

About 2-[2-(diethylamino)ethyl]-5-(propylamino)pyridazin-3-one

2-[2-(diethylamino)ethyl]-5-(propylamino)pyridazin-3-one (PubChem CID 103220143) has the molecular formula C13H24N4O and a molecular weight of 252.36 g/mol. Its IUPAC name is 2-[2-(diethylamino)ethyl]-5-(propylamino)pyridazin-3-one.

Molecular Properties

Compound Name2-[2-(diethylamino)ethyl]-5-(propylamino)pyridazin-3-one
PubChem CID103220143
Molecular FormulaC13H24N4O
Molecular Weight252.36 g/mol
Exact Mass252.20
IUPAC Name2-[2-(diethylamino)ethyl]-5-(propylamino)pyridazin-3-one
SMILESCCCNc1cnn(CCN(CC)CC)c(=O)c1
InChIInChI=1S/C13H24N4O/c1-4-7-14-12-10-13(18)17(15-11-12)9-8-16(5-2)6-3/h10-11,14H,4-9H2,1-3H3
InChIKeyYUGCGZGVLCWRRY-UHFFFAOYSA-N
XLogP1.41
TPSA50.16 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.36
LogP ≤ 51.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 2-[2-(diethylamino)ethyl]-5-(propylamino)pyridazin-3-one 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

3-[4-(4-methyl-1-piperazinyl)-6-oxo-1(6H)-pyridazinyl]propanamide
CID 56910372
2-(Dimethylamino)-N-[1-(1-ethyl-6-oxo-1,6-dihydropyridazin-4-YL)piperidin-4-YL]acetamide
CID 91924057
5-(Piperazin-1-yl)pyridazin-3(2H)-one
CID 17976142
N~2~-methyl-N~1~-{[1-(1-methyl-6-oxo-1,6-dihydro-4-pyridazinyl)-3-pyrrolidinyl]methyl}glycinamide
CID 70761816
2-[4-(dimethylamino)-6-oxopyridazin-1(6H)-yl]-N-(1,1-dimethylpropyl)acetamide
CID 72901531
2-[4-(methylamino)-6-oxopyridazin-1-yl]-N-(2,2,2-trifluoroethyl)acetamide
CID 103218675
2-[4-(ethylamino)-6-oxopyridazin-1-yl]-N-(2,2,2-trifluoroethyl)acetamide
CID 103219116
2-[6-oxo-4-(propylamino)pyridazin-1-yl]-N-(2,2,2-trifluoroethyl)acetamide
CID 103220293
2-[4-(2-methylpropylamino)-6-oxopyridazin-1-yl]-N-(2,2,2-trifluoroethyl)acetamide
CID 103221646
2-[4-[2-aminoethyl(methyl)amino]-6-oxopyridazin-1-yl]-N-(2,2,2-trifluoroethyl)acetamide
CID 103223469
5-[2-Aminoethyl(methyl)amino]-2-[3-(2,2,2-trifluoroethoxy)propyl]pyridazin-3-one
CID 103223496
2-[4-[2-(methylamino)ethylamino]-6-oxopyridazin-1-yl]-N-(2,2,2-trifluoroethyl)acetamide
CID 103223681

Frequently Asked Questions

What is the IUPAC name of 2-[2-(diethylamino)ethyl]-5-(propylamino)pyridazin-3-one?
The IUPAC name of 2-[2-(diethylamino)ethyl]-5-(propylamino)pyridazin-3-one (CID 103220143) is 2-[2-(diethylamino)ethyl]-5-(propylamino)pyridazin-3-one.
What is the SMILES notation for 2-[2-(diethylamino)ethyl]-5-(propylamino)pyridazin-3-one?
The canonical SMILES for 2-[2-(diethylamino)ethyl]-5-(propylamino)pyridazin-3-one is CCCNc1cnn(CCN(CC)CC)c(=O)c1.
What is the InChIKey of 2-[2-(diethylamino)ethyl]-5-(propylamino)pyridazin-3-one?
The InChIKey is YUGCGZGVLCWRRY-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N4O/c1-4-7-14-12-10-13(18)17(15-11-12)9-8-16(5-2)6-3/h10-11,14H,4-9H2,1-3H3.
What are the key properties of 2-[2-(diethylamino)ethyl]-5-(propylamino)pyridazin-3-one?
2-[2-(diethylamino)ethyl]-5-(propylamino)pyridazin-3-one has a molecular weight of 252.36 g/mol, XLogP of 1.41, 8 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(diethylamino)ethyl]-5-(propylamino)pyridazin-3-one is sourced from PubChem (CID 103220143), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).