6-amino-2-(pyridin-3-ylmethyl)pyridazin-3-one

C10H10N4O — CID 116788200

IUPAC6-amino-2-(pyridin-3-ylmethyl)pyridazin-3-one
SMILESNc1ccc(=O)n(Cc2cccnc2)n1
InChIInChI=1S/C10H10N4O/c11-9-3-4-10(15)14(13-9)7-8-2-1-5-12-6-8/h1-6H,7H2,(H2,11,13)
InChIKeyLIHSJKQAXCCVMT-UHFFFAOYSA-N
MW202.22 g/mol
LogP0.27
Rot. Bonds2

About 6-amino-2-(pyridin-3-ylmethyl)pyridazin-3-one

6-amino-2-(pyridin-3-ylmethyl)pyridazin-3-one (PubChem CID 116788200) has the molecular formula C10H10N4O and a molecular weight of 202.22 g/mol. Its IUPAC name is 6-amino-2-(pyridin-3-ylmethyl)pyridazin-3-one.

Molecular Properties

Compound Name6-amino-2-(pyridin-3-ylmethyl)pyridazin-3-one
PubChem CID116788200
Molecular FormulaC10H10N4O
Molecular Weight202.22 g/mol
Exact Mass202.09
IUPAC Name6-amino-2-(pyridin-3-ylmethyl)pyridazin-3-one
SMILESNc1ccc(=O)n(Cc2cccnc2)n1
InChIInChI=1S/C10H10N4O/c11-9-3-4-10(15)14(13-9)7-8-2-1-5-12-6-8/h1-6H,7H2,(H2,11,13)
InChIKeyLIHSJKQAXCCVMT-UHFFFAOYSA-N
XLogP0.27
TPSA73.80 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.22
LogP ≤ 50.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 6-amino-2-(pyridin-3-ylmethyl)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-(pyridin-3-ylmethyl)pyridazin-3-one
CID 126857261
6-amino-2-[(3-chlorophenyl)methyl]pyridazin-3-one
CID 116788203
5-methyl-1-(pyridin-3-ylmethyl)pyrazol-4-amine
CID 118365737
2-(pyridin-3-ylmethyl)pyrazol-3-amine
CID 1096899
5-methyl-2-(pyridin-3-ylmethyl)pyrazol-3-amine
CID 3161320
4-phenyl-2-(pyridin-3-ylmethyl)phthalazin-1-one
CID 166185401
(6S,7R)-4-(pyridin-3-ylmethyl)-4-azatricyclo[5.2.1.02,6]dec-8-ene-3,5-dione
CID 134952389
(1R,2S,6S,7R)-4-(pyridin-3-ylmethyl)-4-azatricyclo[5.2.1.02,6]dec-8-ene-3,5-dione
CID 98125002
6-amino-2-(2-pyrazol-1-ylethyl)pyridazin-3-one
CID 116788167
1-methyl-3-(pyridin-3-ylmethyl)pyrrolo[1,2-d][1,2,4]triazin-4-one
CID 16668872
(3S,6S)-3,6-dimethyl-1,4-bis(pyridin-3-ylmethyl)piperazine-2,5-dione
CID 155810252
4-amino-1-(pyridin-3-ylmethyl)pyrazole-3-carboxylic acid
CID 107344308

Frequently Asked Questions

What is the IUPAC name of 6-amino-2-(pyridin-3-ylmethyl)pyridazin-3-one?
The IUPAC name of 6-amino-2-(pyridin-3-ylmethyl)pyridazin-3-one (CID 116788200) is 6-amino-2-(pyridin-3-ylmethyl)pyridazin-3-one.
What is the SMILES notation for 6-amino-2-(pyridin-3-ylmethyl)pyridazin-3-one?
The canonical SMILES for 6-amino-2-(pyridin-3-ylmethyl)pyridazin-3-one is Nc1ccc(=O)n(Cc2cccnc2)n1.
What is the InChIKey of 6-amino-2-(pyridin-3-ylmethyl)pyridazin-3-one?
The InChIKey is LIHSJKQAXCCVMT-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10N4O/c11-9-3-4-10(15)14(13-9)7-8-2-1-5-12-6-8/h1-6H,7H2,(H2,11,13).
What are the key properties of 6-amino-2-(pyridin-3-ylmethyl)pyridazin-3-one?
6-amino-2-(pyridin-3-ylmethyl)pyridazin-3-one has a molecular weight of 202.22 g/mol, XLogP of 0.27, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-amino-2-(pyridin-3-ylmethyl)pyridazin-3-one is sourced from PubChem (CID 116788200), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).