(6-chloroimidazo[1,2-b]pyridazin-3-yl)methanamine

C7H7ClN4 — CID 11480847

IUPAC(6-chloroimidazo[1,2-b]pyridazin-3-yl)methanamine
SMILESNCc1cnc2ccc(Cl)nn12
InChIInChI=1S/C7H7ClN4/c8-6-1-2-7-10-4-5(3-9)12(7)11-6/h1-2,4H,3,9H2
InChIKeyJRGKCCXDSNQAFE-UHFFFAOYSA-N
MW182.61 g/mol
LogP0.84
Rot. Bonds1

About (6-chloroimidazo[1,2-b]pyridazin-3-yl)methanamine

(6-chloroimidazo[1,2-b]pyridazin-3-yl)methanamine (PubChem CID 11480847) has the molecular formula C7H7ClN4 and a molecular weight of 182.61 g/mol. Its IUPAC name is (6-chloroimidazo[1,2-b]pyridazin-3-yl)methanamine.

Molecular Properties

Compound Name(6-chloroimidazo[1,2-b]pyridazin-3-yl)methanamine
PubChem CID11480847
Molecular FormulaC7H7ClN4
Molecular Weight182.61 g/mol
Exact Mass182.04
IUPAC Name(6-chloroimidazo[1,2-b]pyridazin-3-yl)methanamine
SMILESNCc1cnc2ccc(Cl)nn12
InChIInChI=1S/C7H7ClN4/c8-6-1-2-7-10-4-5(3-9)12(7)11-6/h1-2,4H,3,9H2
InChIKeyJRGKCCXDSNQAFE-UHFFFAOYSA-N
XLogP0.84
TPSA56.21 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.61
LogP ≤ 50.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of (6-chloroimidazo[1,2-b]pyridazin-3-yl)methanamine?
The IUPAC name of (6-chloroimidazo[1,2-b]pyridazin-3-yl)methanamine (CID 11480847) is (6-chloroimidazo[1,2-b]pyridazin-3-yl)methanamine.
What is the SMILES notation for (6-chloroimidazo[1,2-b]pyridazin-3-yl)methanamine?
The canonical SMILES for (6-chloroimidazo[1,2-b]pyridazin-3-yl)methanamine is NCc1cnc2ccc(Cl)nn12.
What is the InChIKey of (6-chloroimidazo[1,2-b]pyridazin-3-yl)methanamine?
The InChIKey is JRGKCCXDSNQAFE-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H7ClN4/c8-6-1-2-7-10-4-5(3-9)12(7)11-6/h1-2,4H,3,9H2.
What are the key properties of (6-chloroimidazo[1,2-b]pyridazin-3-yl)methanamine?
(6-chloroimidazo[1,2-b]pyridazin-3-yl)methanamine has a molecular weight of 182.61 g/mol, XLogP of 0.84, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (6-chloroimidazo[1,2-b]pyridazin-3-yl)methanamine is sourced from PubChem (CID 11480847), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).