6-amino-2-[2-(dimethylamino)ethyl]pyridazin-3-one

C8H14N4O — CID 116788154

IUPAC6-amino-2-[2-(dimethylamino)ethyl]pyridazin-3-one
SMILESCN(C)CCn1nc(N)ccc1=O
InChIInChI=1S/C8H14N4O/c1-11(2)5-6-12-8(13)4-3-7(9)10-12/h3-4H,5-6H2,1-2H3,(H2,9,10)
InChIKeyJXKSPRMAFPCODN-UHFFFAOYSA-N
MW182.23 g/mol
LogP-0.61
Rot. Bonds3

About 6-amino-2-[2-(dimethylamino)ethyl]pyridazin-3-one

6-amino-2-[2-(dimethylamino)ethyl]pyridazin-3-one (PubChem CID 116788154) has the molecular formula C8H14N4O and a molecular weight of 182.23 g/mol. Its IUPAC name is 6-amino-2-[2-(dimethylamino)ethyl]pyridazin-3-one.

Molecular Properties

Compound Name6-amino-2-[2-(dimethylamino)ethyl]pyridazin-3-one
PubChem CID116788154
Molecular FormulaC8H14N4O
Molecular Weight182.23 g/mol
Exact Mass182.12
IUPAC Name6-amino-2-[2-(dimethylamino)ethyl]pyridazin-3-one
SMILESCN(C)CCn1nc(N)ccc1=O
InChIInChI=1S/C8H14N4O/c1-11(2)5-6-12-8(13)4-3-7(9)10-12/h3-4H,5-6H2,1-2H3,(H2,9,10)
InChIKeyJXKSPRMAFPCODN-UHFFFAOYSA-N
XLogP-0.61
TPSA64.15 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.23
LogP ≤ 5-0.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 6-amino-2-[2-(dimethylamino)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

Frequently Asked Questions

What is the IUPAC name of 6-amino-2-[2-(dimethylamino)ethyl]pyridazin-3-one?
The IUPAC name of 6-amino-2-[2-(dimethylamino)ethyl]pyridazin-3-one (CID 116788154) is 6-amino-2-[2-(dimethylamino)ethyl]pyridazin-3-one.
What is the SMILES notation for 6-amino-2-[2-(dimethylamino)ethyl]pyridazin-3-one?
The canonical SMILES for 6-amino-2-[2-(dimethylamino)ethyl]pyridazin-3-one is CN(C)CCn1nc(N)ccc1=O.
What is the InChIKey of 6-amino-2-[2-(dimethylamino)ethyl]pyridazin-3-one?
The InChIKey is JXKSPRMAFPCODN-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14N4O/c1-11(2)5-6-12-8(13)4-3-7(9)10-12/h3-4H,5-6H2,1-2H3,(H2,9,10).
What are the key properties of 6-amino-2-[2-(dimethylamino)ethyl]pyridazin-3-one?
6-amino-2-[2-(dimethylamino)ethyl]pyridazin-3-one has a molecular weight of 182.23 g/mol, XLogP of -0.61, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-amino-2-[2-(dimethylamino)ethyl]pyridazin-3-one is sourced from PubChem (CID 116788154), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).