N-(3,4-dimethoxyphenyl)-6-phenylimidazo[1,2-b]pyridazin-3-amine

C20H18N4O2 — CID 134807022

IUPACN-(3,4-dimethoxyphenyl)-6-phenylimidazo[1,2-b]pyridazin-3-amine
SMILESCOc1ccc(Nc2cnc3ccc(-c4ccccc4)nn23)cc1OC
InChIInChI=1S/C20H18N4O2/c1-25-17-10-8-15(12-18(17)26-2)22-20-13-21-19-11-9-16(23-24(19)20)14-6-4-3-5-7-14/h3-13,22H,1-2H3
InChIKeyLOHTXJSVMUPGOE-UHFFFAOYSA-N
MW346.39 g/mol
LogP4.16
Rot. Bonds5

About N-(3,4-dimethoxyphenyl)-6-phenylimidazo[1,2-b]pyridazin-3-amine

N-(3,4-dimethoxyphenyl)-6-phenylimidazo[1,2-b]pyridazin-3-amine (PubChem CID 134807022) has the molecular formula C20H18N4O2 and a molecular weight of 346.39 g/mol. Its IUPAC name is N-(3,4-dimethoxyphenyl)-6-phenylimidazo[1,2-b]pyridazin-3-amine.

Molecular Properties

Compound NameN-(3,4-dimethoxyphenyl)-6-phenylimidazo[1,2-b]pyridazin-3-amine
PubChem CID134807022
Molecular FormulaC20H18N4O2
Molecular Weight346.39 g/mol
Exact Mass346.14
IUPAC NameN-(3,4-dimethoxyphenyl)-6-phenylimidazo[1,2-b]pyridazin-3-amine
SMILESCOc1ccc(Nc2cnc3ccc(-c4ccccc4)nn23)cc1OC
InChIInChI=1S/C20H18N4O2/c1-25-17-10-8-15(12-18(17)26-2)22-20-13-21-19-11-9-16(23-24(19)20)14-6-4-3-5-7-14/h3-13,22H,1-2H3
InChIKeyLOHTXJSVMUPGOE-UHFFFAOYSA-N
XLogP4.16
TPSA60.68 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500346.39
LogP ≤ 54.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-(3,4-dimethoxyphenyl)-6-phenylimidazo[1,2-b]pyridazin-3-amine?
The IUPAC name of N-(3,4-dimethoxyphenyl)-6-phenylimidazo[1,2-b]pyridazin-3-amine (CID 134807022) is N-(3,4-dimethoxyphenyl)-6-phenylimidazo[1,2-b]pyridazin-3-amine.
What is the SMILES notation for N-(3,4-dimethoxyphenyl)-6-phenylimidazo[1,2-b]pyridazin-3-amine?
The canonical SMILES for N-(3,4-dimethoxyphenyl)-6-phenylimidazo[1,2-b]pyridazin-3-amine is COc1ccc(Nc2cnc3ccc(-c4ccccc4)nn23)cc1OC.
What is the InChIKey of N-(3,4-dimethoxyphenyl)-6-phenylimidazo[1,2-b]pyridazin-3-amine?
The InChIKey is LOHTXJSVMUPGOE-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H18N4O2/c1-25-17-10-8-15(12-18(17)26-2)22-20-13-21-19-11-9-16(23-24(19)20)14-6-4-3-5-7-14/h3-13,22H,1-2H3.
What are the key properties of N-(3,4-dimethoxyphenyl)-6-phenylimidazo[1,2-b]pyridazin-3-amine?
N-(3,4-dimethoxyphenyl)-6-phenylimidazo[1,2-b]pyridazin-3-amine has a molecular weight of 346.39 g/mol, XLogP of 4.16, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,4-dimethoxyphenyl)-6-phenylimidazo[1,2-b]pyridazin-3-amine is sourced from PubChem (CID 134807022), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).