N-(5,6-dimethoxy-2-pyridinyl)-6-phenylimidazo[1,2-b]pyridazin-8-amine

C19H17N5O2 — CID 71525990

IUPACN-(5,6-dimethoxy-2-pyridinyl)-6-phenylimidazo[1,2-b]pyridazin-8-amine
SMILESCOc1ccc(Nc2cc(-c3ccccc3)nn3ccnc23)nc1OC
InChIInChI=1S/C19H17N5O2/c1-25-16-8-9-17(22-19(16)26-2)21-15-12-14(13-6-4-3-5-7-13)23-24-11-10-20-18(15)24/h3-12H,1-2H3,(H,21,22)
InChIKeyMMPRXLIDAZSRPM-UHFFFAOYSA-N
MW347.38 g/mol
LogP3.55
Rot. Bonds5

About N-(5,6-dimethoxy-2-pyridinyl)-6-phenylimidazo[1,2-b]pyridazin-8-amine

N-(5,6-dimethoxy-2-pyridinyl)-6-phenylimidazo[1,2-b]pyridazin-8-amine (PubChem CID 71525990) has the molecular formula C19H17N5O2 and a molecular weight of 347.38 g/mol. Its IUPAC name is N-(5,6-dimethoxy-2-pyridinyl)-6-phenylimidazo[1,2-b]pyridazin-8-amine.

Molecular Properties

Compound NameN-(5,6-dimethoxy-2-pyridinyl)-6-phenylimidazo[1,2-b]pyridazin-8-amine
PubChem CID71525990
Molecular FormulaC19H17N5O2
Molecular Weight347.38 g/mol
Exact Mass347.14
IUPAC NameN-(5,6-dimethoxy-2-pyridinyl)-6-phenylimidazo[1,2-b]pyridazin-8-amine
SMILESCOc1ccc(Nc2cc(-c3ccccc3)nn3ccnc23)nc1OC
InChIInChI=1S/C19H17N5O2/c1-25-16-8-9-17(22-19(16)26-2)21-15-12-14(13-6-4-3-5-7-13)23-24-11-10-20-18(15)24/h3-12H,1-2H3,(H,21,22)
InChIKeyMMPRXLIDAZSRPM-UHFFFAOYSA-N
XLogP3.55
TPSA73.57 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500347.38
LogP ≤ 53.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of N-(5,6-dimethoxy-2-pyridinyl)-6-phenylimidazo[1,2-b]pyridazin-8-amine?
The IUPAC name of N-(5,6-dimethoxy-2-pyridinyl)-6-phenylimidazo[1,2-b]pyridazin-8-amine (CID 71525990) is N-(5,6-dimethoxy-2-pyridinyl)-6-phenylimidazo[1,2-b]pyridazin-8-amine.
What is the SMILES notation for N-(5,6-dimethoxy-2-pyridinyl)-6-phenylimidazo[1,2-b]pyridazin-8-amine?
The canonical SMILES for N-(5,6-dimethoxy-2-pyridinyl)-6-phenylimidazo[1,2-b]pyridazin-8-amine is COc1ccc(Nc2cc(-c3ccccc3)nn3ccnc23)nc1OC.
What is the InChIKey of N-(5,6-dimethoxy-2-pyridinyl)-6-phenylimidazo[1,2-b]pyridazin-8-amine?
The InChIKey is MMPRXLIDAZSRPM-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17N5O2/c1-25-16-8-9-17(22-19(16)26-2)21-15-12-14(13-6-4-3-5-7-13)23-24-11-10-20-18(15)24/h3-12H,1-2H3,(H,21,22).
What are the key properties of N-(5,6-dimethoxy-2-pyridinyl)-6-phenylimidazo[1,2-b]pyridazin-8-amine?
N-(5,6-dimethoxy-2-pyridinyl)-6-phenylimidazo[1,2-b]pyridazin-8-amine has a molecular weight of 347.38 g/mol, XLogP of 3.55, 5 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5,6-dimethoxy-2-pyridinyl)-6-phenylimidazo[1,2-b]pyridazin-8-amine is sourced from PubChem (CID 71525990), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).