2-[[2-(6-fluoro-2-pyridinyl)imidazol-1-yl]methyl]-3-propylimidazo[1,2-b]pyridazine

C18H17FN6 — CID 22335093

IUPAC2-[[2-(6-fluoro-2-pyridinyl)imidazol-1-yl]methyl]-3-propylimidazo[1,2-b]pyridazine
SMILESCCCc1c(Cn2ccnc2-c2cccc(F)n2)nc2cccnn12
InChIInChI=1S/C18H17FN6/c1-2-5-15-14(23-17-8-4-9-21-25(15)17)12-24-11-10-20-18(24)13-6-3-7-16(19)22-13/h3-4,6-11H,2,5,12H2,1H3
InChIKeyLHWDKZPZWHDOMC-UHFFFAOYSA-N
MW336.37 g/mol
LogP3.13
Rot. Bonds5

About 2-[[2-(6-fluoro-2-pyridinyl)imidazol-1-yl]methyl]-3-propylimidazo[1,2-b]pyridazine

2-[[2-(6-fluoro-2-pyridinyl)imidazol-1-yl]methyl]-3-propylimidazo[1,2-b]pyridazine (PubChem CID 22335093) has the molecular formula C18H17FN6 and a molecular weight of 336.37 g/mol. Its IUPAC name is 2-[[2-(6-fluoro-2-pyridinyl)imidazol-1-yl]methyl]-3-propylimidazo[1,2-b]pyridazine.

Molecular Properties

Compound Name2-[[2-(6-fluoro-2-pyridinyl)imidazol-1-yl]methyl]-3-propylimidazo[1,2-b]pyridazine
PubChem CID22335093
Molecular FormulaC18H17FN6
Molecular Weight336.37 g/mol
Exact Mass336.15
IUPAC Name2-[[2-(6-fluoro-2-pyridinyl)imidazol-1-yl]methyl]-3-propylimidazo[1,2-b]pyridazine
SMILESCCCc1c(Cn2ccnc2-c2cccc(F)n2)nc2cccnn12
InChIInChI=1S/C18H17FN6/c1-2-5-15-14(23-17-8-4-9-21-25(15)17)12-24-11-10-20-18(24)13-6-3-7-16(19)22-13/h3-4,6-11H,2,5,12H2,1H3
InChIKeyLHWDKZPZWHDOMC-UHFFFAOYSA-N
XLogP3.13
TPSA60.90 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500336.37
LogP ≤ 53.13
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

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Related Compounds

6-[[2-(6-fluoro-2-pyridinyl)imidazol-1-yl]methyl]-1-methyl-5-propylimidazo[1,5-a]pyrazine
CID 58748663
5-[[2-(6-fluoro-2-pyridinyl)imidazol-1-yl]methyl]-6-propylpyrazin-2-amine
CID 58748668
7-[[2-(6-fluoro-2-pyridinyl)imidazol-1-yl]methyl]-5-methyl-8-propylimidazo[1,2-c]pyrimidine
CID 11245036
5-ethyl-6-[[2-(6-fluoro-2-pyridinyl)imidazol-1-yl]methyl]imidazo[2,1-b][1,3]thiazole
CID 22335063
6-chloro-N,N-diethyl-3-[[2-(6-fluoro-2-pyridinyl)imidazol-1-yl]methyl]pyridazin-4-amine
CID 10451188
7-[2-[2-(6-fluoro-2-pyridinyl)imidazol-1-yl]ethyl]-1-methyl-8-propylimidazo[1,5-c]pyrimidine
CID 142683030
ethyl 7-[[2-(6-fluoro-2-pyridinyl)imidazol-1-yl]methyl]-8-propylimidazo[1,2-c]pyrimidine-3-carboxylate
CID 11189011
2-[[2-(6-chloro-2-pyridinyl)imidazol-1-yl]methyl]-3-ethyl-N-methylimidazo[1,2-b]pyridazin-6-amine
CID 87940435
3-ethyl-2-[[2-(6-fluoro-2-pyridinyl)imidazol-1-yl]methyl]-5-(trifluoromethyl)imidazo[4,5-b]pyridine
CID 59542840
2-[3-ethyl-2-[(2-pyrimidin-2-ylimidazol-1-yl)methyl]imidazo[1,2-b]pyridazin-6-yl]-1,3-thiazole
CID 57456766
2,6-bis(1-ethylimidazol-2-yl)pyridine;cobalt(3+);trichloride
CID 70011500
2-methyl-6-[1-(pyridin-2-ylmethyl)imidazol-2-yl]pyridine
CID 156586380

Frequently Asked Questions

What is the IUPAC name of 2-[[2-(6-fluoro-2-pyridinyl)imidazol-1-yl]methyl]-3-propylimidazo[1,2-b]pyridazine?
The IUPAC name of 2-[[2-(6-fluoro-2-pyridinyl)imidazol-1-yl]methyl]-3-propylimidazo[1,2-b]pyridazine (CID 22335093) is 2-[[2-(6-fluoro-2-pyridinyl)imidazol-1-yl]methyl]-3-propylimidazo[1,2-b]pyridazine.
What is the SMILES notation for 2-[[2-(6-fluoro-2-pyridinyl)imidazol-1-yl]methyl]-3-propylimidazo[1,2-b]pyridazine?
The canonical SMILES for 2-[[2-(6-fluoro-2-pyridinyl)imidazol-1-yl]methyl]-3-propylimidazo[1,2-b]pyridazine is CCCc1c(Cn2ccnc2-c2cccc(F)n2)nc2cccnn12.
What is the InChIKey of 2-[[2-(6-fluoro-2-pyridinyl)imidazol-1-yl]methyl]-3-propylimidazo[1,2-b]pyridazine?
The InChIKey is LHWDKZPZWHDOMC-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H17FN6/c1-2-5-15-14(23-17-8-4-9-21-25(15)17)12-24-11-10-20-18(24)13-6-3-7-16(19)22-13/h3-4,6-11H,2,5,12H2,1H3.
What are the key properties of 2-[[2-(6-fluoro-2-pyridinyl)imidazol-1-yl]methyl]-3-propylimidazo[1,2-b]pyridazine?
2-[[2-(6-fluoro-2-pyridinyl)imidazol-1-yl]methyl]-3-propylimidazo[1,2-b]pyridazine has a molecular weight of 336.37 g/mol, XLogP of 3.13, 5 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[2-(6-fluoro-2-pyridinyl)imidazol-1-yl]methyl]-3-propylimidazo[1,2-b]pyridazine is sourced from PubChem (CID 22335093), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).