6-[(4-chloro-2-fluorophenyl)methyl]imidazo[1,2-b]pyridazine

C13H9ClFN3 — CID 167388670

IUPAC6-[(4-chloro-2-fluorophenyl)methyl]imidazo[1,2-b]pyridazine
SMILESFc1cc(Cl)ccc1Cc1ccc2nccn2n1
InChIInChI=1S/C13H9ClFN3/c14-10-2-1-9(12(15)8-10)7-11-3-4-13-16-5-6-18(13)17-11/h1-6,8H,7H2
InChIKeyMKWFUWWXPQWVCD-UHFFFAOYSA-N
MW261.69 g/mol
LogP3.11
Rot. Bonds2

About 6-[(4-chloro-2-fluorophenyl)methyl]imidazo[1,2-b]pyridazine

6-[(4-chloro-2-fluorophenyl)methyl]imidazo[1,2-b]pyridazine (PubChem CID 167388670) has the molecular formula C13H9ClFN3 and a molecular weight of 261.69 g/mol. Its IUPAC name is 6-[(4-chloro-2-fluorophenyl)methyl]imidazo[1,2-b]pyridazine.

Molecular Properties

Compound Name6-[(4-chloro-2-fluorophenyl)methyl]imidazo[1,2-b]pyridazine
PubChem CID167388670
Molecular FormulaC13H9ClFN3
Molecular Weight261.69 g/mol
Exact Mass261.05
IUPAC Name6-[(4-chloro-2-fluorophenyl)methyl]imidazo[1,2-b]pyridazine
SMILESFc1cc(Cl)ccc1Cc1ccc2nccn2n1
InChIInChI=1S/C13H9ClFN3/c14-10-2-1-9(12(15)8-10)7-11-3-4-13-16-5-6-18(13)17-11/h1-6,8H,7H2
InChIKeyMKWFUWWXPQWVCD-UHFFFAOYSA-N
XLogP3.11
TPSA30.19 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.69
LogP ≤ 53.11
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

6-(chloromethyl)imidazo[1,2-b]pyridazine;ethane
CID 91462782
6-propylimidazo[1,2-b]pyridazine
CID 67266395
6-(2,2-dimethylpropyl)imidazo[1,2-b]pyridazine
CID 67988768
6-(3,4-difluorophenyl)imidazo[1,2-b]pyridazine
CID 116854254
6-[(4-chloro-2-fluorophenyl)methylamino]imidazo[1,2-a]pyridine-5-carboxylic acid
CID 139430325
1-[1-[(4-chloro-2-fluorophenyl)methyl]-1,2,4-triazol-3-yl]-N-methylmethanamine
CID 114859930
[1-[(4-chloro-2-fluorophenyl)methyl]-1,2,4-triazol-3-yl]methanamine
CID 114859929
2-imidazo[1,2-b]pyridazin-6-ylsulfanylethanamine
CID 19854390
N-[(4-chloro-2-fluorophenyl)methyl]-2-methylpyridin-3-amine
CID 114842458
6-(4-ethoxy-3-fluorophenyl)imidazo[1,2-b]pyridazine
CID 116854261
N-[[1-[(4-chloro-2-fluorophenyl)methyl]pyrazol-3-yl]methyl]-2-methylpropan-1-amine
CID 114859898
6-chloro-2-[(2-fluorophenyl)methyl]-[1,2,4]triazolo[1,5-a]pyridine
CID 117130502

Frequently Asked Questions

What is the IUPAC name of 6-[(4-chloro-2-fluorophenyl)methyl]imidazo[1,2-b]pyridazine?
The IUPAC name of 6-[(4-chloro-2-fluorophenyl)methyl]imidazo[1,2-b]pyridazine (CID 167388670) is 6-[(4-chloro-2-fluorophenyl)methyl]imidazo[1,2-b]pyridazine.
What is the SMILES notation for 6-[(4-chloro-2-fluorophenyl)methyl]imidazo[1,2-b]pyridazine?
The canonical SMILES for 6-[(4-chloro-2-fluorophenyl)methyl]imidazo[1,2-b]pyridazine is Fc1cc(Cl)ccc1Cc1ccc2nccn2n1.
What is the InChIKey of 6-[(4-chloro-2-fluorophenyl)methyl]imidazo[1,2-b]pyridazine?
The InChIKey is MKWFUWWXPQWVCD-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H9ClFN3/c14-10-2-1-9(12(15)8-10)7-11-3-4-13-16-5-6-18(13)17-11/h1-6,8H,7H2.
What are the key properties of 6-[(4-chloro-2-fluorophenyl)methyl]imidazo[1,2-b]pyridazine?
6-[(4-chloro-2-fluorophenyl)methyl]imidazo[1,2-b]pyridazine has a molecular weight of 261.69 g/mol, XLogP of 3.11, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[(4-chloro-2-fluorophenyl)methyl]imidazo[1,2-b]pyridazine is sourced from PubChem (CID 167388670), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).