ethyl 6-pyrrolidin-1-ylimidazo[1,2-b]pyridazine-2-carboxylate

C13H16N4O2 — CID 2815677

IUPACethyl 6-pyrrolidin-1-ylimidazo[1,2-b]pyridazine-2-carboxylate
SMILESCCOC(=O)c1cn2nc(N3CCCC3)ccc2n1
InChIInChI=1S/C13H16N4O2/c1-2-19-13(18)10-9-17-11(14-10)5-6-12(15-17)16-7-3-4-8-16/h5-6,9H,2-4,7-8H2,1H3
InChIKeySCYHSGDDLVFVOP-UHFFFAOYSA-N
MW260.30 g/mol
LogP1.51
Rot. Bonds3

About ethyl 6-pyrrolidin-1-ylimidazo[1,2-b]pyridazine-2-carboxylate

ethyl 6-pyrrolidin-1-ylimidazo[1,2-b]pyridazine-2-carboxylate (PubChem CID 2815677) has the molecular formula C13H16N4O2 and a molecular weight of 260.30 g/mol. Its IUPAC name is ethyl 6-pyrrolidin-1-ylimidazo[1,2-b]pyridazine-2-carboxylate.

Molecular Properties

Compound Nameethyl 6-pyrrolidin-1-ylimidazo[1,2-b]pyridazine-2-carboxylate
PubChem CID2815677
Molecular FormulaC13H16N4O2
Molecular Weight260.30 g/mol
Exact Mass260.13
IUPAC Nameethyl 6-pyrrolidin-1-ylimidazo[1,2-b]pyridazine-2-carboxylate
SMILESCCOC(=O)c1cn2nc(N3CCCC3)ccc2n1
InChIInChI=1S/C13H16N4O2/c1-2-19-13(18)10-9-17-11(14-10)5-6-12(15-17)16-7-3-4-8-16/h5-6,9H,2-4,7-8H2,1H3
InChIKeySCYHSGDDLVFVOP-UHFFFAOYSA-N
XLogP1.51
TPSA59.73 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.30
LogP ≤ 51.51
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze ethyl 6-pyrrolidin-1-ylimidazo[1,2-b]pyridazine-2-carboxylate 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

Ethyl 6-piperidinoimidazo[1,2-b]pyridazine-2-carboxylate
CID 2815688
Ethyl 3-iodoimidazo[1,2-b]pyridazine-2-carboxylate
CID 118863061
Imidazo(1,2-b)pyridazine-2-carboxylic acid, 6-chloro-, ethyl ester
CID 2779714
Imidazo(1,2-b)pyridazine-2-carboxylic acid
CID 10583132
Imidazo(1,2-b)pyridazine-3-carboxylic acid
CID 22024514
Methyl 6-chloroimidazo(1,2-b)pyridazine-3-carboxylate
CID 92135192
Imidazo(1,2-b)pyridazine-2-carboxylic acid hydrochloride
CID 154878715
Methyl 6-chloroimidazo(1,2-b)pyridazine-2-carboxylate
CID 37818753
Ethyl 6-chloroimidazo[1,2-b]pyridazine-3-carboxylate
CID 56766637
8-Morpholinoimidazo[1,2-b]pyridazine-2-carbaldehyde
CID 117728638
6-(2-(Trifluoromethyl)pyrrolidin-1-yl)imidazo[1,2-b]pyridazine-3-carboxylic acid
CID 89515409
6-(3-Fluoropyrrolidin-1-yl)imidazo[1,2-b]pyridazine-3-carboxylic acid
CID 89515414

Frequently Asked Questions

What is the IUPAC name of ethyl 6-pyrrolidin-1-ylimidazo[1,2-b]pyridazine-2-carboxylate?
The IUPAC name of ethyl 6-pyrrolidin-1-ylimidazo[1,2-b]pyridazine-2-carboxylate (CID 2815677) is ethyl 6-pyrrolidin-1-ylimidazo[1,2-b]pyridazine-2-carboxylate.
What is the SMILES notation for ethyl 6-pyrrolidin-1-ylimidazo[1,2-b]pyridazine-2-carboxylate?
The canonical SMILES for ethyl 6-pyrrolidin-1-ylimidazo[1,2-b]pyridazine-2-carboxylate is CCOC(=O)c1cn2nc(N3CCCC3)ccc2n1.
What is the InChIKey of ethyl 6-pyrrolidin-1-ylimidazo[1,2-b]pyridazine-2-carboxylate?
The InChIKey is SCYHSGDDLVFVOP-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16N4O2/c1-2-19-13(18)10-9-17-11(14-10)5-6-12(15-17)16-7-3-4-8-16/h5-6,9H,2-4,7-8H2,1H3.
What are the key properties of ethyl 6-pyrrolidin-1-ylimidazo[1,2-b]pyridazine-2-carboxylate?
ethyl 6-pyrrolidin-1-ylimidazo[1,2-b]pyridazine-2-carboxylate has a molecular weight of 260.30 g/mol, XLogP of 1.51, 3 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl 6-pyrrolidin-1-ylimidazo[1,2-b]pyridazine-2-carboxylate is sourced from PubChem (CID 2815677), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).