3-(6-pyridin-3-ylimidazo[1,2-b]pyridazin-3-yl)phenol

C17H12N4O — CID 71447485

IUPAC3-(6-pyridin-3-ylimidazo[1,2-b]pyridazin-3-yl)phenol
SMILESOc1cccc(-c2cnc3ccc(-c4cccnc4)nn23)c1
InChIInChI=1S/C17H12N4O/c22-14-5-1-3-12(9-14)16-11-19-17-7-6-15(20-21(16)17)13-4-2-8-18-10-13/h1-11,22H
InChIKeyQMPNKRUFLSLFBL-UHFFFAOYSA-N
MW288.31 g/mol
LogP3.16
Rot. Bonds2

About 3-(6-pyridin-3-ylimidazo[1,2-b]pyridazin-3-yl)phenol

3-(6-pyridin-3-ylimidazo[1,2-b]pyridazin-3-yl)phenol (PubChem CID 71447485) has the molecular formula C17H12N4O and a molecular weight of 288.31 g/mol. Its IUPAC name is 3-(6-pyridin-3-ylimidazo[1,2-b]pyridazin-3-yl)phenol.

Molecular Properties

Compound Name3-(6-pyridin-3-ylimidazo[1,2-b]pyridazin-3-yl)phenol
PubChem CID71447485
Molecular FormulaC17H12N4O
Molecular Weight288.31 g/mol
Exact Mass288.10
IUPAC Name3-(6-pyridin-3-ylimidazo[1,2-b]pyridazin-3-yl)phenol
SMILESOc1cccc(-c2cnc3ccc(-c4cccnc4)nn23)c1
InChIInChI=1S/C17H12N4O/c22-14-5-1-3-12(9-14)16-11-19-17-7-6-15(20-21(16)17)13-4-2-8-18-10-13/h1-11,22H
InChIKeyQMPNKRUFLSLFBL-UHFFFAOYSA-N
XLogP3.16
TPSA63.31 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.31
LogP ≤ 53.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

3-(6-pyridin-4-ylimidazo[1,2-b]pyridazin-3-yl)phenol
CID 126672883
N-[3-(6-pyridin-3-ylimidazo[1,2-b]pyridazin-3-yl)phenyl]acetamide
CID 90480157
3-(6-quinolin-5-ylimidazo[1,2-b]pyridazin-3-yl)phenol
CID 90479882
6-chloro-3-phenylimidazo[1,2-b]pyridazine;6-chloro-3-pyridin-3-ylimidazo[1,2-b]pyridazine
CID 167431604
3,6-bis(3-methylsulfinylphenyl)imidazo[1,2-b]pyridazine
CID 155537745
1-[3-[6-(3-chlorophenyl)imidazo[1,2-b]pyridazin-3-yl]phenyl]ethanone
CID 155556179
3-[6-[3-(diethylamino)propoxy]imidazo[1,2-b]pyridazin-3-yl]phenol
CID 71154364
3-[6-(3,4-dimethylanilino)imidazo[1,2-b]pyridazin-3-yl]phenol
CID 90393302
3-(3-fluorophenyl)-6-(2-pyridin-3-ylethyl)imidazo[1,2-b]pyridazine
CID 173083961
3-[3-[3-(trifluoromethyl)phenyl]imidazo[1,2-b]pyridazin-6-yl]aniline
CID 155551586
1-[3-(7-pyridin-3-ylimidazo[1,2-b]pyridazin-3-yl)phenyl]ethanone
CID 25174294
6-[3-(methoxymethyl)phenyl]-3-[3-(trifluoromethoxy)phenyl]imidazo[1,2-b]pyridazine
CID 162753468

Frequently Asked Questions

What is the IUPAC name of 3-(6-pyridin-3-ylimidazo[1,2-b]pyridazin-3-yl)phenol?
The IUPAC name of 3-(6-pyridin-3-ylimidazo[1,2-b]pyridazin-3-yl)phenol (CID 71447485) is 3-(6-pyridin-3-ylimidazo[1,2-b]pyridazin-3-yl)phenol.
What is the SMILES notation for 3-(6-pyridin-3-ylimidazo[1,2-b]pyridazin-3-yl)phenol?
The canonical SMILES for 3-(6-pyridin-3-ylimidazo[1,2-b]pyridazin-3-yl)phenol is Oc1cccc(-c2cnc3ccc(-c4cccnc4)nn23)c1.
What is the InChIKey of 3-(6-pyridin-3-ylimidazo[1,2-b]pyridazin-3-yl)phenol?
The InChIKey is QMPNKRUFLSLFBL-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H12N4O/c22-14-5-1-3-12(9-14)16-11-19-17-7-6-15(20-21(16)17)13-4-2-8-18-10-13/h1-11,22H.
What are the key properties of 3-(6-pyridin-3-ylimidazo[1,2-b]pyridazin-3-yl)phenol?
3-(6-pyridin-3-ylimidazo[1,2-b]pyridazin-3-yl)phenol has a molecular weight of 288.31 g/mol, XLogP of 3.16, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(6-pyridin-3-ylimidazo[1,2-b]pyridazin-3-yl)phenol is sourced from PubChem (CID 71447485), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).