N-[3-(3-phenylimidazo[1,2-b]pyridazin-6-yl)phenyl]acetamide

C20H16N4O — CID 126673252

IUPACN-[3-(3-phenylimidazo[1,2-b]pyridazin-6-yl)phenyl]acetamide
SMILESCC(=O)Nc1cccc(-c2ccc3ncc(-c4ccccc4)n3n2)c1
InChIInChI=1S/C20H16N4O/c1-14(25)22-17-9-5-8-16(12-17)18-10-11-20-21-13-19(24(20)23-18)15-6-3-2-4-7-15/h2-13H,1H3,(H,22,25)
InChIKeyCHRDNENWXSWODY-UHFFFAOYSA-N
MW328.38 g/mol
LogP4.02
Rot. Bonds3

About N-[3-(3-phenylimidazo[1,2-b]pyridazin-6-yl)phenyl]acetamide

N-[3-(3-phenylimidazo[1,2-b]pyridazin-6-yl)phenyl]acetamide (PubChem CID 126673252) has the molecular formula C20H16N4O and a molecular weight of 328.38 g/mol. Its IUPAC name is N-[3-(3-phenylimidazo[1,2-b]pyridazin-6-yl)phenyl]acetamide.

Molecular Properties

Compound NameN-[3-(3-phenylimidazo[1,2-b]pyridazin-6-yl)phenyl]acetamide
PubChem CID126673252
Molecular FormulaC20H16N4O
Molecular Weight328.38 g/mol
Exact Mass328.13
IUPAC NameN-[3-(3-phenylimidazo[1,2-b]pyridazin-6-yl)phenyl]acetamide
SMILESCC(=O)Nc1cccc(-c2ccc3ncc(-c4ccccc4)n3n2)c1
InChIInChI=1S/C20H16N4O/c1-14(25)22-17-9-5-8-16(12-17)18-10-11-20-21-13-19(24(20)23-18)15-6-3-2-4-7-15/h2-13H,1H3,(H,22,25)
InChIKeyCHRDNENWXSWODY-UHFFFAOYSA-N
XLogP4.02
TPSA59.29 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.38
LogP ≤ 54.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[3-(3-phenylimidazo[1,2-b]pyridazin-6-yl)phenyl]acetamide?
The IUPAC name of N-[3-(3-phenylimidazo[1,2-b]pyridazin-6-yl)phenyl]acetamide (CID 126673252) is N-[3-(3-phenylimidazo[1,2-b]pyridazin-6-yl)phenyl]acetamide.
What is the SMILES notation for N-[3-(3-phenylimidazo[1,2-b]pyridazin-6-yl)phenyl]acetamide?
The canonical SMILES for N-[3-(3-phenylimidazo[1,2-b]pyridazin-6-yl)phenyl]acetamide is CC(=O)Nc1cccc(-c2ccc3ncc(-c4ccccc4)n3n2)c1.
What is the InChIKey of N-[3-(3-phenylimidazo[1,2-b]pyridazin-6-yl)phenyl]acetamide?
The InChIKey is CHRDNENWXSWODY-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H16N4O/c1-14(25)22-17-9-5-8-16(12-17)18-10-11-20-21-13-19(24(20)23-18)15-6-3-2-4-7-15/h2-13H,1H3,(H,22,25).
What are the key properties of N-[3-(3-phenylimidazo[1,2-b]pyridazin-6-yl)phenyl]acetamide?
N-[3-(3-phenylimidazo[1,2-b]pyridazin-6-yl)phenyl]acetamide has a molecular weight of 328.38 g/mol, XLogP of 4.02, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(3-phenylimidazo[1,2-b]pyridazin-6-yl)phenyl]acetamide is sourced from PubChem (CID 126673252), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).