N'-[6-(2,8-dimethylimidazo[1,2-b]pyridazin-6-yl)-8-fluoroimidazo[1,2-a]pyridin-2-yl]ethane-1,2-diamine

C17H18FN7 — CID 170593804

IUPACN'-[6-(2,8-dimethylimidazo[1,2-b]pyridazin-6-yl)-8-fluoroimidazo[1,2-a]pyridin-2-yl]ethane-1,2-diamine
SMILESCc1cn2nc(-c3cc(F)c4nc(NCCN)cn4c3)cc(C)c2n1
InChIInChI=1S/C17H18FN7/c1-10-5-14(23-25-7-11(2)21-16(10)25)12-6-13(18)17-22-15(20-4-3-19)9-24(17)8-12/h5-9,20H,3-4,19H2,1-2H3
InChIKeyZCCDXKAGGNIBGZ-UHFFFAOYSA-N
MW339.38 g/mol
LogP2.17
Rot. Bonds4

About N'-[6-(2,8-dimethylimidazo[1,2-b]pyridazin-6-yl)-8-fluoroimidazo[1,2-a]pyridin-2-yl]ethane-1,2-diamine

N'-[6-(2,8-dimethylimidazo[1,2-b]pyridazin-6-yl)-8-fluoroimidazo[1,2-a]pyridin-2-yl]ethane-1,2-diamine (PubChem CID 170593804) has the molecular formula C17H18FN7 and a molecular weight of 339.38 g/mol. Its IUPAC name is N'-[6-(2,8-dimethylimidazo[1,2-b]pyridazin-6-yl)-8-fluoroimidazo[1,2-a]pyridin-2-yl]ethane-1,2-diamine.

Molecular Properties

Compound NameN'-[6-(2,8-dimethylimidazo[1,2-b]pyridazin-6-yl)-8-fluoroimidazo[1,2-a]pyridin-2-yl]ethane-1,2-diamine
PubChem CID170593804
Molecular FormulaC17H18FN7
Molecular Weight339.38 g/mol
Exact Mass339.16
IUPAC NameN'-[6-(2,8-dimethylimidazo[1,2-b]pyridazin-6-yl)-8-fluoroimidazo[1,2-a]pyridin-2-yl]ethane-1,2-diamine
SMILESCc1cn2nc(-c3cc(F)c4nc(NCCN)cn4c3)cc(C)c2n1
InChIInChI=1S/C17H18FN7/c1-10-5-14(23-25-7-11(2)21-16(10)25)12-6-13(18)17-22-15(20-4-3-19)9-24(17)8-12/h5-9,20H,3-4,19H2,1-2H3
InChIKeyZCCDXKAGGNIBGZ-UHFFFAOYSA-N
XLogP2.17
TPSA85.54 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500339.38
LogP ≤ 52.17
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

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Related Compounds

N-[6-(2,8-dimethylimidazo[1,2-b]pyridazin-6-yl)-8-fluoroimidazo[1,2-a]pyridin-2-yl]formamide
CID 170593703
6-(2-cyclopent-3-en-1-yl-8-fluoroimidazo[1,2-a]pyridin-6-yl)-2,8-dimethylimidazo[1,2-b]pyridazine
CID 170340773
6-(8-fluoro-2-pyrrolidin-3-ylimidazo[1,2-a]pyridin-6-yl)-2,8-dimethylimidazo[1,2-b]pyridazine
CID 170593872
6-[8-fluoro-2-[(1S,5R)-3-methyl-3-azabicyclo[3.1.0]hexan-6-yl]imidazo[1,2-a]pyridin-6-yl]-2,8-dimethylimidazo[1,2-b]pyridazine
CID 170593790
6-[2-[1-(cyclopropylmethyl)piperidin-4-yl]-8-fluoroimidazo[1,2-a]pyridin-6-yl]-2,8-dimethylimidazo[1,2-b]pyridazine
CID 170593629
6-[2-(2-azabicyclo[2.1.1]hexan-4-yl)-8-fluoroimidazo[1,2-a]pyridin-6-yl]-2,8-dimethylimidazo[1,2-b]pyridazine
CID 170593754
6-(2,8-dimethylimidazo[1,2-b]pyridazin-6-yl)-8-fluoro-N-[[(2R)-piperidin-2-yl]methyl]imidazo[1,2-a]pyridine-2-carboxamide
CID 170340784
6-(4,5-dimethyl-2-pyridinyl)-8-fluoro-2-methylimidazo[1,2-a]pyridine
CID 153383007
N-[(7R)-4-azaspiro[2.5]octan-7-yl]-6-(2,8-dimethylimidazo[1,2-b]pyridazin-6-yl)-8-fluoroimidazo[1,2-a]pyridine-2-carboxamide
CID 177038524
6-[8-fluoro-2-[1-(3-methoxypropyl)piperidin-4-yl]imidazo[1,2-a]pyridin-6-yl]-2,8-dimethylimidazo[1,2-b]pyridazine
CID 170593597
6-[8-fluoro-2-[1-(oxolan-3-yl)piperidin-4-yl]imidazo[1,2-a]pyridin-6-yl]-2,8-dimethylimidazo[1,2-b]pyridazine
CID 170593502
8-ethyl-6-(8-fluoro-2-piperidin-4-ylimidazo[1,2-a]pyridin-6-yl)-2-methylimidazo[1,2-b]pyridazine
CID 170593680

Frequently Asked Questions

What is the IUPAC name of N'-[6-(2,8-dimethylimidazo[1,2-b]pyridazin-6-yl)-8-fluoroimidazo[1,2-a]pyridin-2-yl]ethane-1,2-diamine?
The IUPAC name of N'-[6-(2,8-dimethylimidazo[1,2-b]pyridazin-6-yl)-8-fluoroimidazo[1,2-a]pyridin-2-yl]ethane-1,2-diamine (CID 170593804) is N'-[6-(2,8-dimethylimidazo[1,2-b]pyridazin-6-yl)-8-fluoroimidazo[1,2-a]pyridin-2-yl]ethane-1,2-diamine.
What is the SMILES notation for N'-[6-(2,8-dimethylimidazo[1,2-b]pyridazin-6-yl)-8-fluoroimidazo[1,2-a]pyridin-2-yl]ethane-1,2-diamine?
The canonical SMILES for N'-[6-(2,8-dimethylimidazo[1,2-b]pyridazin-6-yl)-8-fluoroimidazo[1,2-a]pyridin-2-yl]ethane-1,2-diamine is Cc1cn2nc(-c3cc(F)c4nc(NCCN)cn4c3)cc(C)c2n1.
What is the InChIKey of N'-[6-(2,8-dimethylimidazo[1,2-b]pyridazin-6-yl)-8-fluoroimidazo[1,2-a]pyridin-2-yl]ethane-1,2-diamine?
The InChIKey is ZCCDXKAGGNIBGZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18FN7/c1-10-5-14(23-25-7-11(2)21-16(10)25)12-6-13(18)17-22-15(20-4-3-19)9-24(17)8-12/h5-9,20H,3-4,19H2,1-2H3.
What are the key properties of N'-[6-(2,8-dimethylimidazo[1,2-b]pyridazin-6-yl)-8-fluoroimidazo[1,2-a]pyridin-2-yl]ethane-1,2-diamine?
N'-[6-(2,8-dimethylimidazo[1,2-b]pyridazin-6-yl)-8-fluoroimidazo[1,2-a]pyridin-2-yl]ethane-1,2-diamine has a molecular weight of 339.38 g/mol, XLogP of 2.17, 4 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N'-[6-(2,8-dimethylimidazo[1,2-b]pyridazin-6-yl)-8-fluoroimidazo[1,2-a]pyridin-2-yl]ethane-1,2-diamine is sourced from PubChem (CID 170593804), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).