6-ethoxy-N-[(2-fluorophenyl)methyl]imidazo[1,2-b]pyridazine-2-carboxamide

C16H15FN4O2 — CID 87051087

IUPAC6-ethoxy-N-[(2-fluorophenyl)methyl]imidazo[1,2-b]pyridazine-2-carboxamide
SMILESCCOc1ccc2nc(C(=O)NCc3ccccc3F)cn2n1
InChIInChI=1S/C16H15FN4O2/c1-2-23-15-8-7-14-19-13(10-21(14)20-15)16(22)18-9-11-5-3-4-6-12(11)17/h3-8,10H,2,9H2,1H3,(H,18,22)
InChIKeyRKOYHKGYQAHKQF-UHFFFAOYSA-N
MW314.32 g/mol
LogP2.20
Rot. Bonds5

About 6-ethoxy-N-[(2-fluorophenyl)methyl]imidazo[1,2-b]pyridazine-2-carboxamide

6-ethoxy-N-[(2-fluorophenyl)methyl]imidazo[1,2-b]pyridazine-2-carboxamide (PubChem CID 87051087) has the molecular formula C16H15FN4O2 and a molecular weight of 314.32 g/mol. Its IUPAC name is 6-ethoxy-N-[(2-fluorophenyl)methyl]imidazo[1,2-b]pyridazine-2-carboxamide.

Molecular Properties

Compound Name6-ethoxy-N-[(2-fluorophenyl)methyl]imidazo[1,2-b]pyridazine-2-carboxamide
PubChem CID87051087
Molecular FormulaC16H15FN4O2
Molecular Weight314.32 g/mol
Exact Mass314.12
IUPAC Name6-ethoxy-N-[(2-fluorophenyl)methyl]imidazo[1,2-b]pyridazine-2-carboxamide
SMILESCCOc1ccc2nc(C(=O)NCc3ccccc3F)cn2n1
InChIInChI=1S/C16H15FN4O2/c1-2-23-15-8-7-14-19-13(10-21(14)20-15)16(22)18-9-11-5-3-4-6-12(11)17/h3-8,10H,2,9H2,1H3,(H,18,22)
InChIKeyRKOYHKGYQAHKQF-UHFFFAOYSA-N
XLogP2.20
TPSA68.52 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500314.32
LogP ≤ 52.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-[(3-chloro-4-fluorophenyl)methyl]-6-ethoxyimidazo[1,2-b]pyridazine-2-carboxamide
CID 87051090
N-[(2,4-dimethoxyphenyl)methyl]-6-ethoxyimidazo[1,2-b]pyridazine-2-carboxamide
CID 87051100
6-ethoxy-N-(2-piperidin-1-ylethyl)imidazo[1,2-b]pyridazine-2-carboxamide
CID 87051144
N-[(3-ethoxyphenyl)methyl]-6-methoxyimidazo[1,2-b]pyridazine-2-carboxamide
CID 87051043
2-cyclopropyl-N-[(2-fluorophenyl)methyl]imidazo[1,2-b]pyridazine-6-carboxamide
CID 154854059
N-[(3-fluorophenyl)methyl]-6-methoxyimidazo[1,2-b]pyridazine-2-carboxamide
CID 53166432
6-ethoxy-N-(3-methoxyphenyl)imidazo[1,2-b]pyridazine-2-carboxamide
CID 87051064
5-(2-ethoxyanilino)-N-[(2-fluorophenyl)methyl]pyridine-2-carboxamide
CID 109189418
1-(2-aminoethyl)-N-[(2-fluorophenyl)methyl]imidazole-4-carboxamide
CID 107495694
N-[(2-fluorophenyl)methyl]-1,3-oxazole-4-carboxamide
CID 110689474
N-[(2-fluorophenyl)methyl]-1,5-dimethylpyrazole-3-carboxamide
CID 110685754
6-fluoro-N-[(2-fluorophenyl)methyl]pyridine-2-carboxamide
CID 115496596

Frequently Asked Questions

What is the IUPAC name of 6-ethoxy-N-[(2-fluorophenyl)methyl]imidazo[1,2-b]pyridazine-2-carboxamide?
The IUPAC name of 6-ethoxy-N-[(2-fluorophenyl)methyl]imidazo[1,2-b]pyridazine-2-carboxamide (CID 87051087) is 6-ethoxy-N-[(2-fluorophenyl)methyl]imidazo[1,2-b]pyridazine-2-carboxamide.
What is the SMILES notation for 6-ethoxy-N-[(2-fluorophenyl)methyl]imidazo[1,2-b]pyridazine-2-carboxamide?
The canonical SMILES for 6-ethoxy-N-[(2-fluorophenyl)methyl]imidazo[1,2-b]pyridazine-2-carboxamide is CCOc1ccc2nc(C(=O)NCc3ccccc3F)cn2n1.
What is the InChIKey of 6-ethoxy-N-[(2-fluorophenyl)methyl]imidazo[1,2-b]pyridazine-2-carboxamide?
The InChIKey is RKOYHKGYQAHKQF-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15FN4O2/c1-2-23-15-8-7-14-19-13(10-21(14)20-15)16(22)18-9-11-5-3-4-6-12(11)17/h3-8,10H,2,9H2,1H3,(H,18,22).
What are the key properties of 6-ethoxy-N-[(2-fluorophenyl)methyl]imidazo[1,2-b]pyridazine-2-carboxamide?
6-ethoxy-N-[(2-fluorophenyl)methyl]imidazo[1,2-b]pyridazine-2-carboxamide has a molecular weight of 314.32 g/mol, XLogP of 2.20, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-ethoxy-N-[(2-fluorophenyl)methyl]imidazo[1,2-b]pyridazine-2-carboxamide is sourced from PubChem (CID 87051087), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).