N-[6-[2-(4-fluorophenyl)pyrazolo[1,5-a]pyridin-3-yl]imidazo[1,2-b]pyridazin-2-yl]acetamide

C21H15FN6O — CID 118608298

IUPACN-[6-[2-(4-fluorophenyl)pyrazolo[1,5-a]pyridin-3-yl]imidazo[1,2-b]pyridazin-2-yl]acetamide
SMILESCC(=O)Nc1cn2nc(-c3c(-c4ccc(F)cc4)nn4ccccc34)ccc2n1
InChIInChI=1S/C21H15FN6O/c1-13(29)23-18-12-28-19(24-18)10-9-16(25-28)20-17-4-2-3-11-27(17)26-21(20)14-5-7-15(22)8-6-14/h2-12H,1H3,(H,23,29)
InChIKeyNMORECASECSRGF-UHFFFAOYSA-N
MW386.39 g/mol
LogP3.81
Rot. Bonds3

About N-[6-[2-(4-fluorophenyl)pyrazolo[1,5-a]pyridin-3-yl]imidazo[1,2-b]pyridazin-2-yl]acetamide

N-[6-[2-(4-fluorophenyl)pyrazolo[1,5-a]pyridin-3-yl]imidazo[1,2-b]pyridazin-2-yl]acetamide (PubChem CID 118608298) has the molecular formula C21H15FN6O and a molecular weight of 386.39 g/mol. Its IUPAC name is N-[6-[2-(4-fluorophenyl)pyrazolo[1,5-a]pyridin-3-yl]imidazo[1,2-b]pyridazin-2-yl]acetamide.

Molecular Properties

Compound NameN-[6-[2-(4-fluorophenyl)pyrazolo[1,5-a]pyridin-3-yl]imidazo[1,2-b]pyridazin-2-yl]acetamide
PubChem CID118608298
Molecular FormulaC21H15FN6O
Molecular Weight386.39 g/mol
Exact Mass386.13
IUPAC NameN-[6-[2-(4-fluorophenyl)pyrazolo[1,5-a]pyridin-3-yl]imidazo[1,2-b]pyridazin-2-yl]acetamide
SMILESCC(=O)Nc1cn2nc(-c3c(-c4ccc(F)cc4)nn4ccccc34)ccc2n1
InChIInChI=1S/C21H15FN6O/c1-13(29)23-18-12-28-19(24-18)10-9-16(25-28)20-17-4-2-3-11-27(17)26-21(20)14-5-7-15(22)8-6-14/h2-12H,1H3,(H,23,29)
InChIKeyNMORECASECSRGF-UHFFFAOYSA-N
XLogP3.81
TPSA76.59 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500386.39
LogP ≤ 53.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

CID 11304743
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CID 118023034
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CID 54674461
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CID 11198924
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CID 60143346
CID 60143346
CID 129103609
CID 129103609
CID 54766013
CID 54766013
CID 135565709
CID 135565709
CID 129116690
CID 129116690
CID 9798973
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CID 132271862
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CID 90199447
CID 90199447

Frequently Asked Questions

What is the IUPAC name of N-[6-[2-(4-fluorophenyl)pyrazolo[1,5-a]pyridin-3-yl]imidazo[1,2-b]pyridazin-2-yl]acetamide?
The IUPAC name of N-[6-[2-(4-fluorophenyl)pyrazolo[1,5-a]pyridin-3-yl]imidazo[1,2-b]pyridazin-2-yl]acetamide (CID 118608298) is N-[6-[2-(4-fluorophenyl)pyrazolo[1,5-a]pyridin-3-yl]imidazo[1,2-b]pyridazin-2-yl]acetamide.
What is the SMILES notation for N-[6-[2-(4-fluorophenyl)pyrazolo[1,5-a]pyridin-3-yl]imidazo[1,2-b]pyridazin-2-yl]acetamide?
The canonical SMILES for N-[6-[2-(4-fluorophenyl)pyrazolo[1,5-a]pyridin-3-yl]imidazo[1,2-b]pyridazin-2-yl]acetamide is CC(=O)Nc1cn2nc(-c3c(-c4ccc(F)cc4)nn4ccccc34)ccc2n1.
What is the InChIKey of N-[6-[2-(4-fluorophenyl)pyrazolo[1,5-a]pyridin-3-yl]imidazo[1,2-b]pyridazin-2-yl]acetamide?
The InChIKey is NMORECASECSRGF-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H15FN6O/c1-13(29)23-18-12-28-19(24-18)10-9-16(25-28)20-17-4-2-3-11-27(17)26-21(20)14-5-7-15(22)8-6-14/h2-12H,1H3,(H,23,29).
What are the key properties of N-[6-[2-(4-fluorophenyl)pyrazolo[1,5-a]pyridin-3-yl]imidazo[1,2-b]pyridazin-2-yl]acetamide?
N-[6-[2-(4-fluorophenyl)pyrazolo[1,5-a]pyridin-3-yl]imidazo[1,2-b]pyridazin-2-yl]acetamide has a molecular weight of 386.39 g/mol, XLogP of 3.81, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[6-[2-(4-fluorophenyl)pyrazolo[1,5-a]pyridin-3-yl]imidazo[1,2-b]pyridazin-2-yl]acetamide is sourced from PubChem (CID 118608298), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).