3-[3-(furan-3-yl)imidazo[1,2-b]pyridazin-6-yl]-N,N-dimethylaniline

C18H16N4O — CID 71448684

IUPAC3-[3-(furan-3-yl)imidazo[1,2-b]pyridazin-6-yl]-N,N-dimethylaniline
SMILESCN(C)c1cccc(-c2ccc3ncc(-c4ccoc4)n3n2)c1
InChIInChI=1S/C18H16N4O/c1-21(2)15-5-3-4-13(10-15)16-6-7-18-19-11-17(22(18)20-16)14-8-9-23-12-14/h3-12H,1-2H3
InChIKeyQOPQDHQSVNLIIX-UHFFFAOYSA-N
MW304.35 g/mol
LogP3.72
Rot. Bonds3

About 3-[3-(furan-3-yl)imidazo[1,2-b]pyridazin-6-yl]-N,N-dimethylaniline

3-[3-(furan-3-yl)imidazo[1,2-b]pyridazin-6-yl]-N,N-dimethylaniline (PubChem CID 71448684) has the molecular formula C18H16N4O and a molecular weight of 304.35 g/mol. Its IUPAC name is 3-[3-(furan-3-yl)imidazo[1,2-b]pyridazin-6-yl]-N,N-dimethylaniline.

Molecular Properties

Compound Name3-[3-(furan-3-yl)imidazo[1,2-b]pyridazin-6-yl]-N,N-dimethylaniline
PubChem CID71448684
Molecular FormulaC18H16N4O
Molecular Weight304.35 g/mol
Exact Mass304.13
IUPAC Name3-[3-(furan-3-yl)imidazo[1,2-b]pyridazin-6-yl]-N,N-dimethylaniline
SMILESCN(C)c1cccc(-c2ccc3ncc(-c4ccoc4)n3n2)c1
InChIInChI=1S/C18H16N4O/c1-21(2)15-5-3-4-13(10-15)16-6-7-18-19-11-17(22(18)20-16)14-8-9-23-12-14/h3-12H,1-2H3
InChIKeyQOPQDHQSVNLIIX-UHFFFAOYSA-N
XLogP3.72
TPSA46.57 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.35
LogP ≤ 53.72
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 3-[3-(furan-3-yl)imidazo[1,2-b]pyridazin-6-yl]-N,N-dimethylaniline?
The IUPAC name of 3-[3-(furan-3-yl)imidazo[1,2-b]pyridazin-6-yl]-N,N-dimethylaniline (CID 71448684) is 3-[3-(furan-3-yl)imidazo[1,2-b]pyridazin-6-yl]-N,N-dimethylaniline.
What is the SMILES notation for 3-[3-(furan-3-yl)imidazo[1,2-b]pyridazin-6-yl]-N,N-dimethylaniline?
The canonical SMILES for 3-[3-(furan-3-yl)imidazo[1,2-b]pyridazin-6-yl]-N,N-dimethylaniline is CN(C)c1cccc(-c2ccc3ncc(-c4ccoc4)n3n2)c1.
What is the InChIKey of 3-[3-(furan-3-yl)imidazo[1,2-b]pyridazin-6-yl]-N,N-dimethylaniline?
The InChIKey is QOPQDHQSVNLIIX-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H16N4O/c1-21(2)15-5-3-4-13(10-15)16-6-7-18-19-11-17(22(18)20-16)14-8-9-23-12-14/h3-12H,1-2H3.
What are the key properties of 3-[3-(furan-3-yl)imidazo[1,2-b]pyridazin-6-yl]-N,N-dimethylaniline?
3-[3-(furan-3-yl)imidazo[1,2-b]pyridazin-6-yl]-N,N-dimethylaniline has a molecular weight of 304.35 g/mol, XLogP of 3.72, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[3-(furan-3-yl)imidazo[1,2-b]pyridazin-6-yl]-N,N-dimethylaniline is sourced from PubChem (CID 71448684), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).