N-(1-tert-butylpyrazol-3-yl)-6-phenylimidazo[1,2-b]pyridazin-8-amine

C19H20N6 — CID 71525436

IUPACN-(1-tert-butylpyrazol-3-yl)-6-phenylimidazo[1,2-b]pyridazin-8-amine
SMILESCC(C)(C)n1ccc(Nc2cc(-c3ccccc3)nn3ccnc23)n1
InChIInChI=1S/C19H20N6/c1-19(2,3)25-11-9-17(23-25)21-16-13-15(14-7-5-4-6-8-14)22-24-12-10-20-18(16)24/h4-13H,1-3H3,(H,21,23)
InChIKeyMJJFSXVVZXYDEF-UHFFFAOYSA-N
MW332.41 g/mol
LogP4.09
Rot. Bonds3

About N-(1-tert-butylpyrazol-3-yl)-6-phenylimidazo[1,2-b]pyridazin-8-amine

N-(1-tert-butylpyrazol-3-yl)-6-phenylimidazo[1,2-b]pyridazin-8-amine (PubChem CID 71525436) has the molecular formula C19H20N6 and a molecular weight of 332.41 g/mol. Its IUPAC name is N-(1-tert-butylpyrazol-3-yl)-6-phenylimidazo[1,2-b]pyridazin-8-amine.

Molecular Properties

Compound NameN-(1-tert-butylpyrazol-3-yl)-6-phenylimidazo[1,2-b]pyridazin-8-amine
PubChem CID71525436
Molecular FormulaC19H20N6
Molecular Weight332.41 g/mol
Exact Mass332.17
IUPAC NameN-(1-tert-butylpyrazol-3-yl)-6-phenylimidazo[1,2-b]pyridazin-8-amine
SMILESCC(C)(C)n1ccc(Nc2cc(-c3ccccc3)nn3ccnc23)n1
InChIInChI=1S/C19H20N6/c1-19(2,3)25-11-9-17(23-25)21-16-13-15(14-7-5-4-6-8-14)22-24-12-10-20-18(16)24/h4-13H,1-3H3,(H,21,23)
InChIKeyMJJFSXVVZXYDEF-UHFFFAOYSA-N
XLogP4.09
TPSA60.04 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.41
LogP ≤ 54.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-(1-tert-butylpyrazol-3-yl)-6-phenylimidazo[1,2-b]pyridazin-8-amine?
The IUPAC name of N-(1-tert-butylpyrazol-3-yl)-6-phenylimidazo[1,2-b]pyridazin-8-amine (CID 71525436) is N-(1-tert-butylpyrazol-3-yl)-6-phenylimidazo[1,2-b]pyridazin-8-amine.
What is the SMILES notation for N-(1-tert-butylpyrazol-3-yl)-6-phenylimidazo[1,2-b]pyridazin-8-amine?
The canonical SMILES for N-(1-tert-butylpyrazol-3-yl)-6-phenylimidazo[1,2-b]pyridazin-8-amine is CC(C)(C)n1ccc(Nc2cc(-c3ccccc3)nn3ccnc23)n1.
What is the InChIKey of N-(1-tert-butylpyrazol-3-yl)-6-phenylimidazo[1,2-b]pyridazin-8-amine?
The InChIKey is MJJFSXVVZXYDEF-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N6/c1-19(2,3)25-11-9-17(23-25)21-16-13-15(14-7-5-4-6-8-14)22-24-12-10-20-18(16)24/h4-13H,1-3H3,(H,21,23).
What are the key properties of N-(1-tert-butylpyrazol-3-yl)-6-phenylimidazo[1,2-b]pyridazin-8-amine?
N-(1-tert-butylpyrazol-3-yl)-6-phenylimidazo[1,2-b]pyridazin-8-amine has a molecular weight of 332.41 g/mol, XLogP of 4.09, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-tert-butylpyrazol-3-yl)-6-phenylimidazo[1,2-b]pyridazin-8-amine is sourced from PubChem (CID 71525436), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).