2-[2-(dimethylamino)ethyl]-5,6,7,8-tetrahydropyrido[4,3-c]pyridazin-3-one

C11H18N4O — CID 63253377

IUPAC2-[2-(dimethylamino)ethyl]-5,6,7,8-tetrahydropyrido[4,3-c]pyridazin-3-one
SMILESCN(C)CCn1nc2c(cc1=O)CNCC2
InChIInChI=1S/C11H18N4O/c1-14(2)5-6-15-11(16)7-9-8-12-4-3-10(9)13-15/h7,12H,3-6,8H2,1-2H3
InChIKeyMQEGTNSOMYYDTM-UHFFFAOYSA-N
MW222.29 g/mol
LogP-0.55
Rot. Bonds3

About 2-[2-(dimethylamino)ethyl]-5,6,7,8-tetrahydropyrido[4,3-c]pyridazin-3-one

2-[2-(dimethylamino)ethyl]-5,6,7,8-tetrahydropyrido[4,3-c]pyridazin-3-one (PubChem CID 63253377) has the molecular formula C11H18N4O and a molecular weight of 222.29 g/mol. Its IUPAC name is 2-[2-(dimethylamino)ethyl]-5,6,7,8-tetrahydropyrido[4,3-c]pyridazin-3-one.

Molecular Properties

Compound Name2-[2-(dimethylamino)ethyl]-5,6,7,8-tetrahydropyrido[4,3-c]pyridazin-3-one
PubChem CID63253377
Molecular FormulaC11H18N4O
Molecular Weight222.29 g/mol
Exact Mass222.15
IUPAC Name2-[2-(dimethylamino)ethyl]-5,6,7,8-tetrahydropyrido[4,3-c]pyridazin-3-one
SMILESCN(C)CCn1nc2c(cc1=O)CNCC2
InChIInChI=1S/C11H18N4O/c1-14(2)5-6-15-11(16)7-9-8-12-4-3-10(9)13-15/h7,12H,3-6,8H2,1-2H3
InChIKeyMQEGTNSOMYYDTM-UHFFFAOYSA-N
XLogP-0.55
TPSA50.16 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.29
LogP ≤ 5-0.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 2-[2-(dimethylamino)ethyl]-5,6,7,8-tetrahydropyrido[4,3-c]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 2-[2-(dimethylamino)ethyl]-5,6,7,8-tetrahydropyrido[4,3-c]pyridazin-3-one?
The IUPAC name of 2-[2-(dimethylamino)ethyl]-5,6,7,8-tetrahydropyrido[4,3-c]pyridazin-3-one (CID 63253377) is 2-[2-(dimethylamino)ethyl]-5,6,7,8-tetrahydropyrido[4,3-c]pyridazin-3-one.
What is the SMILES notation for 2-[2-(dimethylamino)ethyl]-5,6,7,8-tetrahydropyrido[4,3-c]pyridazin-3-one?
The canonical SMILES for 2-[2-(dimethylamino)ethyl]-5,6,7,8-tetrahydropyrido[4,3-c]pyridazin-3-one is CN(C)CCn1nc2c(cc1=O)CNCC2.
What is the InChIKey of 2-[2-(dimethylamino)ethyl]-5,6,7,8-tetrahydropyrido[4,3-c]pyridazin-3-one?
The InChIKey is MQEGTNSOMYYDTM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N4O/c1-14(2)5-6-15-11(16)7-9-8-12-4-3-10(9)13-15/h7,12H,3-6,8H2,1-2H3.
What are the key properties of 2-[2-(dimethylamino)ethyl]-5,6,7,8-tetrahydropyrido[4,3-c]pyridazin-3-one?
2-[2-(dimethylamino)ethyl]-5,6,7,8-tetrahydropyrido[4,3-c]pyridazin-3-one has a molecular weight of 222.29 g/mol, XLogP of -0.55, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(dimethylamino)ethyl]-5,6,7,8-tetrahydropyrido[4,3-c]pyridazin-3-one is sourced from PubChem (CID 63253377), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).