[3-(4,5-dimethylimidazol-1-yl)-5,6-dimethylpyridazin-4-yl]methanamine

C12H17N5 — CID 55064685

IUPAC[3-(4,5-dimethylimidazol-1-yl)-5,6-dimethylpyridazin-4-yl]methanamine
SMILESCc1nnc(-n2cnc(C)c2C)c(CN)c1C
InChIInChI=1S/C12H17N5/c1-7-8(2)15-16-12(11(7)5-13)17-6-14-9(3)10(17)4/h6H,5,13H2,1-4H3
InChIKeyWGGPXHNHUOYMJP-UHFFFAOYSA-N
MW231.30 g/mol
LogP1.35
Rot. Bonds2

About [3-(4,5-dimethylimidazol-1-yl)-5,6-dimethylpyridazin-4-yl]methanamine

[3-(4,5-dimethylimidazol-1-yl)-5,6-dimethylpyridazin-4-yl]methanamine (PubChem CID 55064685) has the molecular formula C12H17N5 and a molecular weight of 231.30 g/mol. Its IUPAC name is [3-(4,5-dimethylimidazol-1-yl)-5,6-dimethylpyridazin-4-yl]methanamine.

Molecular Properties

Compound Name[3-(4,5-dimethylimidazol-1-yl)-5,6-dimethylpyridazin-4-yl]methanamine
PubChem CID55064685
Molecular FormulaC12H17N5
Molecular Weight231.30 g/mol
Exact Mass231.15
IUPAC Name[3-(4,5-dimethylimidazol-1-yl)-5,6-dimethylpyridazin-4-yl]methanamine
SMILESCc1nnc(-n2cnc(C)c2C)c(CN)c1C
InChIInChI=1S/C12H17N5/c1-7-8(2)15-16-12(11(7)5-13)17-6-14-9(3)10(17)4/h6H,5,13H2,1-4H3
InChIKeyWGGPXHNHUOYMJP-UHFFFAOYSA-N
XLogP1.35
TPSA69.62 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.30
LogP ≤ 51.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze [3-(4,5-dimethylimidazol-1-yl)-5,6-dimethylpyridazin-4-yl]methanamine 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 [3-(4,5-dimethylimidazol-1-yl)-5,6-dimethylpyridazin-4-yl]methanamine?
The IUPAC name of [3-(4,5-dimethylimidazol-1-yl)-5,6-dimethylpyridazin-4-yl]methanamine (CID 55064685) is [3-(4,5-dimethylimidazol-1-yl)-5,6-dimethylpyridazin-4-yl]methanamine.
What is the SMILES notation for [3-(4,5-dimethylimidazol-1-yl)-5,6-dimethylpyridazin-4-yl]methanamine?
The canonical SMILES for [3-(4,5-dimethylimidazol-1-yl)-5,6-dimethylpyridazin-4-yl]methanamine is Cc1nnc(-n2cnc(C)c2C)c(CN)c1C.
What is the InChIKey of [3-(4,5-dimethylimidazol-1-yl)-5,6-dimethylpyridazin-4-yl]methanamine?
The InChIKey is WGGPXHNHUOYMJP-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17N5/c1-7-8(2)15-16-12(11(7)5-13)17-6-14-9(3)10(17)4/h6H,5,13H2,1-4H3.
What are the key properties of [3-(4,5-dimethylimidazol-1-yl)-5,6-dimethylpyridazin-4-yl]methanamine?
[3-(4,5-dimethylimidazol-1-yl)-5,6-dimethylpyridazin-4-yl]methanamine has a molecular weight of 231.30 g/mol, XLogP of 1.35, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [3-(4,5-dimethylimidazol-1-yl)-5,6-dimethylpyridazin-4-yl]methanamine is sourced from PubChem (CID 55064685), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).