2-ethyl-N,N-dipropyl-8-(2,4,6-trimethylphenyl)imidazo[1,2-b]pyridazin-3-amine

C23H32N4 — CID 22024577

IUPAC2-ethyl-N,N-dipropyl-8-(2,4,6-trimethylphenyl)imidazo[1,2-b]pyridazin-3-amine
SMILESCCCN(CCC)c1c(CC)nc2c(-c3c(C)cc(C)cc3C)ccnn12
InChIInChI=1S/C23H32N4/c1-7-12-26(13-8-2)23-20(9-3)25-22-19(10-11-24-27(22)23)21-17(5)14-16(4)15-18(21)6/h10-11,14-15H,7-9,12-13H2,1-6H3
InChIKeyGPZQOXVBCCIAIH-UHFFFAOYSA-N
MW364.54 g/mol
LogP5.51
Rot. Bonds7

About 2-ethyl-N,N-dipropyl-8-(2,4,6-trimethylphenyl)imidazo[1,2-b]pyridazin-3-amine

2-ethyl-N,N-dipropyl-8-(2,4,6-trimethylphenyl)imidazo[1,2-b]pyridazin-3-amine (PubChem CID 22024577) has the molecular formula C23H32N4 and a molecular weight of 364.54 g/mol. Its IUPAC name is 2-ethyl-N,N-dipropyl-8-(2,4,6-trimethylphenyl)imidazo[1,2-b]pyridazin-3-amine.

Molecular Properties

Compound Name2-ethyl-N,N-dipropyl-8-(2,4,6-trimethylphenyl)imidazo[1,2-b]pyridazin-3-amine
PubChem CID22024577
Molecular FormulaC23H32N4
Molecular Weight364.54 g/mol
Exact Mass364.26
IUPAC Name2-ethyl-N,N-dipropyl-8-(2,4,6-trimethylphenyl)imidazo[1,2-b]pyridazin-3-amine
SMILESCCCN(CCC)c1c(CC)nc2c(-c3c(C)cc(C)cc3C)ccnn12
InChIInChI=1S/C23H32N4/c1-7-12-26(13-8-2)23-20(9-3)25-22-19(10-11-24-27(22)23)21-17(5)14-16(4)15-18(21)6/h10-11,14-15H,7-9,12-13H2,1-6H3
InChIKeyGPZQOXVBCCIAIH-UHFFFAOYSA-N
XLogP5.51
TPSA33.43 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500364.54
LogP ≤ 55.51
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-ethyl-N,N-dipropyl-8-(2,4,6-trimethylphenyl)imidazo[1,2-b]pyridazin-3-amine?
The IUPAC name of 2-ethyl-N,N-dipropyl-8-(2,4,6-trimethylphenyl)imidazo[1,2-b]pyridazin-3-amine (CID 22024577) is 2-ethyl-N,N-dipropyl-8-(2,4,6-trimethylphenyl)imidazo[1,2-b]pyridazin-3-amine.
What is the SMILES notation for 2-ethyl-N,N-dipropyl-8-(2,4,6-trimethylphenyl)imidazo[1,2-b]pyridazin-3-amine?
The canonical SMILES for 2-ethyl-N,N-dipropyl-8-(2,4,6-trimethylphenyl)imidazo[1,2-b]pyridazin-3-amine is CCCN(CCC)c1c(CC)nc2c(-c3c(C)cc(C)cc3C)ccnn12.
What is the InChIKey of 2-ethyl-N,N-dipropyl-8-(2,4,6-trimethylphenyl)imidazo[1,2-b]pyridazin-3-amine?
The InChIKey is GPZQOXVBCCIAIH-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H32N4/c1-7-12-26(13-8-2)23-20(9-3)25-22-19(10-11-24-27(22)23)21-17(5)14-16(4)15-18(21)6/h10-11,14-15H,7-9,12-13H2,1-6H3.
What are the key properties of 2-ethyl-N,N-dipropyl-8-(2,4,6-trimethylphenyl)imidazo[1,2-b]pyridazin-3-amine?
2-ethyl-N,N-dipropyl-8-(2,4,6-trimethylphenyl)imidazo[1,2-b]pyridazin-3-amine has a molecular weight of 364.54 g/mol, XLogP of 5.51, 7 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-N,N-dipropyl-8-(2,4,6-trimethylphenyl)imidazo[1,2-b]pyridazin-3-amine is sourced from PubChem (CID 22024577), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).