N-cyclopropyloxy-6-(3-fluorophenoxy)imidazo[1,2-b]pyridazin-2-amine

C15H13FN4O2 — CID 143620600

IUPACN-cyclopropyloxy-6-(3-fluorophenoxy)imidazo[1,2-b]pyridazin-2-amine
SMILESFc1cccc(Oc2ccc3nc(NOC4CC4)cn3n2)c1
InChIInChI=1S/C15H13FN4O2/c16-10-2-1-3-12(8-10)21-15-7-6-14-17-13(9-20(14)18-15)19-22-11-4-5-11/h1-3,6-9,11,19H,4-5H2
InChIKeyXTJWJZHISKAVCC-UHFFFAOYSA-N
MW300.29 g/mol
LogP3.17
Rot. Bonds5

About N-cyclopropyloxy-6-(3-fluorophenoxy)imidazo[1,2-b]pyridazin-2-amine

N-cyclopropyloxy-6-(3-fluorophenoxy)imidazo[1,2-b]pyridazin-2-amine (PubChem CID 143620600) has the molecular formula C15H13FN4O2 and a molecular weight of 300.29 g/mol. Its IUPAC name is N-cyclopropyloxy-6-(3-fluorophenoxy)imidazo[1,2-b]pyridazin-2-amine.

Molecular Properties

Compound NameN-cyclopropyloxy-6-(3-fluorophenoxy)imidazo[1,2-b]pyridazin-2-amine
PubChem CID143620600
Molecular FormulaC15H13FN4O2
Molecular Weight300.29 g/mol
Exact Mass300.10
IUPAC NameN-cyclopropyloxy-6-(3-fluorophenoxy)imidazo[1,2-b]pyridazin-2-amine
SMILESFc1cccc(Oc2ccc3nc(NOC4CC4)cn3n2)c1
InChIInChI=1S/C15H13FN4O2/c16-10-2-1-3-12(8-10)21-15-7-6-14-17-13(9-20(14)18-15)19-22-11-4-5-11/h1-3,6-9,11,19H,4-5H2
InChIKeyXTJWJZHISKAVCC-UHFFFAOYSA-N
XLogP3.17
TPSA60.68 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.29
LogP ≤ 53.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-cyclopropyloxy-6-(3-fluorophenoxy)imidazo[1,2-b]pyridazin-2-amine?
The IUPAC name of N-cyclopropyloxy-6-(3-fluorophenoxy)imidazo[1,2-b]pyridazin-2-amine (CID 143620600) is N-cyclopropyloxy-6-(3-fluorophenoxy)imidazo[1,2-b]pyridazin-2-amine.
What is the SMILES notation for N-cyclopropyloxy-6-(3-fluorophenoxy)imidazo[1,2-b]pyridazin-2-amine?
The canonical SMILES for N-cyclopropyloxy-6-(3-fluorophenoxy)imidazo[1,2-b]pyridazin-2-amine is Fc1cccc(Oc2ccc3nc(NOC4CC4)cn3n2)c1.
What is the InChIKey of N-cyclopropyloxy-6-(3-fluorophenoxy)imidazo[1,2-b]pyridazin-2-amine?
The InChIKey is XTJWJZHISKAVCC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13FN4O2/c16-10-2-1-3-12(8-10)21-15-7-6-14-17-13(9-20(14)18-15)19-22-11-4-5-11/h1-3,6-9,11,19H,4-5H2.
What are the key properties of N-cyclopropyloxy-6-(3-fluorophenoxy)imidazo[1,2-b]pyridazin-2-amine?
N-cyclopropyloxy-6-(3-fluorophenoxy)imidazo[1,2-b]pyridazin-2-amine has a molecular weight of 300.29 g/mol, XLogP of 3.17, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyloxy-6-(3-fluorophenoxy)imidazo[1,2-b]pyridazin-2-amine is sourced from PubChem (CID 143620600), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).