4,6-dimethyl-3-(pyrrolidin-3-ylmethyl)pyridazine

C11H17N3 — CID 135135038

IUPAC4,6-dimethyl-3-(pyrrolidin-3-ylmethyl)pyridazine
SMILESCc1cc(C)c(CC2CCNC2)nn1
InChIInChI=1S/C11H17N3/c1-8-5-9(2)13-14-11(8)6-10-3-4-12-7-10/h5,10,12H,3-4,6-7H2,1-2H3
InChIKeyKCWAZEOHOSJERO-UHFFFAOYSA-N
MW191.28 g/mol
LogP1.25
Rot. Bonds2

About 4,6-dimethyl-3-(pyrrolidin-3-ylmethyl)pyridazine

4,6-dimethyl-3-(pyrrolidin-3-ylmethyl)pyridazine (PubChem CID 135135038) has the molecular formula C11H17N3 and a molecular weight of 191.28 g/mol. Its IUPAC name is 4,6-dimethyl-3-(pyrrolidin-3-ylmethyl)pyridazine.

Molecular Properties

Compound Name4,6-dimethyl-3-(pyrrolidin-3-ylmethyl)pyridazine
PubChem CID135135038
Molecular FormulaC11H17N3
Molecular Weight191.28 g/mol
Exact Mass191.14
IUPAC Name4,6-dimethyl-3-(pyrrolidin-3-ylmethyl)pyridazine
SMILESCc1cc(C)c(CC2CCNC2)nn1
InChIInChI=1S/C11H17N3/c1-8-5-9(2)13-14-11(8)6-10-3-4-12-7-10/h5,10,12H,3-4,6-7H2,1-2H3
InChIKeyKCWAZEOHOSJERO-UHFFFAOYSA-N
XLogP1.25
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.28
LogP ≤ 51.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 4,6-dimethyl-3-(pyrrolidin-3-ylmethyl)pyridazine 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 4,6-dimethyl-3-(pyrrolidin-3-ylmethyl)pyridazine?
The IUPAC name of 4,6-dimethyl-3-(pyrrolidin-3-ylmethyl)pyridazine (CID 135135038) is 4,6-dimethyl-3-(pyrrolidin-3-ylmethyl)pyridazine.
What is the SMILES notation for 4,6-dimethyl-3-(pyrrolidin-3-ylmethyl)pyridazine?
The canonical SMILES for 4,6-dimethyl-3-(pyrrolidin-3-ylmethyl)pyridazine is Cc1cc(C)c(CC2CCNC2)nn1.
What is the InChIKey of 4,6-dimethyl-3-(pyrrolidin-3-ylmethyl)pyridazine?
The InChIKey is KCWAZEOHOSJERO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N3/c1-8-5-9(2)13-14-11(8)6-10-3-4-12-7-10/h5,10,12H,3-4,6-7H2,1-2H3.
What are the key properties of 4,6-dimethyl-3-(pyrrolidin-3-ylmethyl)pyridazine?
4,6-dimethyl-3-(pyrrolidin-3-ylmethyl)pyridazine has a molecular weight of 191.28 g/mol, XLogP of 1.25, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4,6-dimethyl-3-(pyrrolidin-3-ylmethyl)pyridazine is sourced from PubChem (CID 135135038), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).