N-(6-chloroimidazo[1,2-b]pyridazin-2-yl)-N-fluorocyclopropanecarboxamide

C10H8ClFN4O — CID 178180848

IUPACN-(6-chloroimidazo[1,2-b]pyridazin-2-yl)-N-fluorocyclopropanecarboxamide
SMILESO=C(C1CC1)N(F)c1cn2nc(Cl)ccc2n1
InChIInChI=1S/C10H8ClFN4O/c11-7-3-4-8-13-9(5-15(8)14-7)16(12)10(17)6-1-2-6/h3-6H,1-2H2
InChIKeyROZIQSHQLAXVEL-UHFFFAOYSA-N
MW254.65 g/mol
LogP2.01
Rot. Bonds2

About N-(6-chloroimidazo[1,2-b]pyridazin-2-yl)-N-fluorocyclopropanecarboxamide

N-(6-chloroimidazo[1,2-b]pyridazin-2-yl)-N-fluorocyclopropanecarboxamide (PubChem CID 178180848) has the molecular formula C10H8ClFN4O and a molecular weight of 254.65 g/mol. Its IUPAC name is N-(6-chloroimidazo[1,2-b]pyridazin-2-yl)-N-fluorocyclopropanecarboxamide.

Molecular Properties

Compound NameN-(6-chloroimidazo[1,2-b]pyridazin-2-yl)-N-fluorocyclopropanecarboxamide
PubChem CID178180848
Molecular FormulaC10H8ClFN4O
Molecular Weight254.65 g/mol
Exact Mass254.04
IUPAC NameN-(6-chloroimidazo[1,2-b]pyridazin-2-yl)-N-fluorocyclopropanecarboxamide
SMILESO=C(C1CC1)N(F)c1cn2nc(Cl)ccc2n1
InChIInChI=1S/C10H8ClFN4O/c11-7-3-4-8-13-9(5-15(8)14-7)16(12)10(17)6-1-2-6/h3-6H,1-2H2
InChIKeyROZIQSHQLAXVEL-UHFFFAOYSA-N
XLogP2.01
TPSA50.50 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.65
LogP ≤ 52.01
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'N-halo', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-(6-chloroimidazo[1,2-b]pyridazin-2-yl)-N-fluorocyclopropanecarboxamide?
The IUPAC name of N-(6-chloroimidazo[1,2-b]pyridazin-2-yl)-N-fluorocyclopropanecarboxamide (CID 178180848) is N-(6-chloroimidazo[1,2-b]pyridazin-2-yl)-N-fluorocyclopropanecarboxamide.
What is the SMILES notation for N-(6-chloroimidazo[1,2-b]pyridazin-2-yl)-N-fluorocyclopropanecarboxamide?
The canonical SMILES for N-(6-chloroimidazo[1,2-b]pyridazin-2-yl)-N-fluorocyclopropanecarboxamide is O=C(C1CC1)N(F)c1cn2nc(Cl)ccc2n1.
What is the InChIKey of N-(6-chloroimidazo[1,2-b]pyridazin-2-yl)-N-fluorocyclopropanecarboxamide?
The InChIKey is ROZIQSHQLAXVEL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8ClFN4O/c11-7-3-4-8-13-9(5-15(8)14-7)16(12)10(17)6-1-2-6/h3-6H,1-2H2.
What are the key properties of N-(6-chloroimidazo[1,2-b]pyridazin-2-yl)-N-fluorocyclopropanecarboxamide?
N-(6-chloroimidazo[1,2-b]pyridazin-2-yl)-N-fluorocyclopropanecarboxamide has a molecular weight of 254.65 g/mol, XLogP of 2.01, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(6-chloroimidazo[1,2-b]pyridazin-2-yl)-N-fluorocyclopropanecarboxamide is sourced from PubChem (CID 178180848), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).