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

C15H26N4O2 — CID 114397695

IUPAC5-(diethylamino)-2-[2-(oxolan-2-ylmethylamino)ethyl]pyridazin-3-one
SMILESCCN(CC)c1cnn(CCNCC2CCCO2)c(=O)c1
InChIInChI=1S/C15H26N4O2/c1-3-18(4-2)13-10-15(20)19(17-11-13)8-7-16-12-14-6-5-9-21-14/h10-11,14,16H,3-9,12H2,1-2H3
InChIKeyHLIKLTNVZWMSCZ-UHFFFAOYSA-N
MW294.40 g/mol
LogP0.86
Rot. Bonds8

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

5-(diethylamino)-2-[2-(oxolan-2-ylmethylamino)ethyl]pyridazin-3-one (PubChem CID 114397695) has the molecular formula C15H26N4O2 and a molecular weight of 294.40 g/mol. Its IUPAC name is 5-(diethylamino)-2-[2-(oxolan-2-ylmethylamino)ethyl]pyridazin-3-one.

Molecular Properties

Compound Name5-(diethylamino)-2-[2-(oxolan-2-ylmethylamino)ethyl]pyridazin-3-one
PubChem CID114397695
Molecular FormulaC15H26N4O2
Molecular Weight294.40 g/mol
Exact Mass294.21
IUPAC Name5-(diethylamino)-2-[2-(oxolan-2-ylmethylamino)ethyl]pyridazin-3-one
SMILESCCN(CC)c1cnn(CCNCC2CCCO2)c(=O)c1
InChIInChI=1S/C15H26N4O2/c1-3-18(4-2)13-10-15(20)19(17-11-13)8-7-16-12-14-6-5-9-21-14/h10-11,14,16H,3-9,12H2,1-2H3
InChIKeyHLIKLTNVZWMSCZ-UHFFFAOYSA-N
XLogP0.86
TPSA59.39 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds8
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.40
LogP ≤ 50.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

Analyze 5-(diethylamino)-2-[2-(oxolan-2-ylmethylamino)ethyl]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

2-[2-(cyclopentylmethylamino)ethyl]-5-(diethylamino)pyridazin-3-one
CID 114397665
5-(diethylamino)-2-[2-(oxan-4-ylamino)ethyl]pyridazin-3-one
CID 114397688
2-[2-(oxolan-2-ylmethylamino)ethyl]pyridazin-3-one
CID 62848753
6-methyl-2-[2-(oxolan-2-ylmethylamino)ethyl]pyridazin-3-one
CID 55156072
5-(diethylamino)-2-[3-(propylamino)propyl]pyridazin-3-one
CID 114394971
5-(diethylamino)-2-[2-(pentan-3-ylamino)ethyl]pyridazin-3-one
CID 114397706
5-(diethylamino)-2-[3-(propan-2-ylamino)propyl]pyridazin-3-one
CID 114394941
5-(diethylamino)-2-(2-sulfanylethyl)pyridazin-3-one
CID 114399061
5-(dimethylamino)-2-[2-[1-(oxolan-2-yl)ethylamino]ethyl]pyridazin-3-one
CID 114397448
2-(4-chlorobutyl)-5-(diethylamino)pyridazin-3-one
CID 114394352
1-ethyl-3-[2-(oxolan-2-ylmethylamino)ethyl]pyrimidine-2,4-dione
CID 63810079
2-(4-bromo-3,5-dimethylpyrazol-1-yl)-N-(oxolan-2-ylmethyl)ethanamine
CID 55088130

Frequently Asked Questions

What is the IUPAC name of 5-(diethylamino)-2-[2-(oxolan-2-ylmethylamino)ethyl]pyridazin-3-one?
The IUPAC name of 5-(diethylamino)-2-[2-(oxolan-2-ylmethylamino)ethyl]pyridazin-3-one (CID 114397695) is 5-(diethylamino)-2-[2-(oxolan-2-ylmethylamino)ethyl]pyridazin-3-one.
What is the SMILES notation for 5-(diethylamino)-2-[2-(oxolan-2-ylmethylamino)ethyl]pyridazin-3-one?
The canonical SMILES for 5-(diethylamino)-2-[2-(oxolan-2-ylmethylamino)ethyl]pyridazin-3-one is CCN(CC)c1cnn(CCNCC2CCCO2)c(=O)c1.
What is the InChIKey of 5-(diethylamino)-2-[2-(oxolan-2-ylmethylamino)ethyl]pyridazin-3-one?
The InChIKey is HLIKLTNVZWMSCZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N4O2/c1-3-18(4-2)13-10-15(20)19(17-11-13)8-7-16-12-14-6-5-9-21-14/h10-11,14,16H,3-9,12H2,1-2H3.
What are the key properties of 5-(diethylamino)-2-[2-(oxolan-2-ylmethylamino)ethyl]pyridazin-3-one?
5-(diethylamino)-2-[2-(oxolan-2-ylmethylamino)ethyl]pyridazin-3-one has a molecular weight of 294.40 g/mol, XLogP of 0.86, 8 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(diethylamino)-2-[2-(oxolan-2-ylmethylamino)ethyl]pyridazin-3-one is sourced from PubChem (CID 114397695), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).