3-methyl-2-phenyl-6-[4-(pyridin-2-ylmethyl)piperazin-1-yl]imidazo[1,2-b]pyridazine

C23H24N6 — CID 67983035

IUPAC3-methyl-2-phenyl-6-[4-(pyridin-2-ylmethyl)piperazin-1-yl]imidazo[1,2-b]pyridazine
SMILESCc1c(-c2ccccc2)nc2ccc(N3CCN(Cc4ccccn4)CC3)nn12
InChIInChI=1S/C23H24N6/c1-18-23(19-7-3-2-4-8-19)25-21-10-11-22(26-29(18)21)28-15-13-27(14-16-28)17-20-9-5-6-12-24-20/h2-12H,13-17H2,1H3
InChIKeyAYYSCWRFSGHMBN-UHFFFAOYSA-N
MW384.49 g/mol
LogP3.42
Rot. Bonds4

About 3-methyl-2-phenyl-6-[4-(pyridin-2-ylmethyl)piperazin-1-yl]imidazo[1,2-b]pyridazine

3-methyl-2-phenyl-6-[4-(pyridin-2-ylmethyl)piperazin-1-yl]imidazo[1,2-b]pyridazine (PubChem CID 67983035) has the molecular formula C23H24N6 and a molecular weight of 384.49 g/mol. Its IUPAC name is 3-methyl-2-phenyl-6-[4-(pyridin-2-ylmethyl)piperazin-1-yl]imidazo[1,2-b]pyridazine.

Molecular Properties

Compound Name3-methyl-2-phenyl-6-[4-(pyridin-2-ylmethyl)piperazin-1-yl]imidazo[1,2-b]pyridazine
PubChem CID67983035
Molecular FormulaC23H24N6
Molecular Weight384.49 g/mol
Exact Mass384.21
IUPAC Name3-methyl-2-phenyl-6-[4-(pyridin-2-ylmethyl)piperazin-1-yl]imidazo[1,2-b]pyridazine
SMILESCc1c(-c2ccccc2)nc2ccc(N3CCN(Cc4ccccn4)CC3)nn12
InChIInChI=1S/C23H24N6/c1-18-23(19-7-3-2-4-8-19)25-21-10-11-22(26-29(18)21)28-15-13-27(14-16-28)17-20-9-5-6-12-24-20/h2-12H,13-17H2,1H3
InChIKeyAYYSCWRFSGHMBN-UHFFFAOYSA-N
XLogP3.42
TPSA49.56 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500384.49
LogP ≤ 53.42
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Related Compounds

3-methyl-2-phenyl-6-[4-(pyridin-4-ylmethyl)piperazin-1-yl]imidazo[1,2-b]pyridazine
CID 57407086
3-(2-fluorophenyl)-6-[4-(pyridin-2-ylmethyl)piperazin-1-yl]-[1,2,4]triazolo[4,3-b]pyridazine
CID 133330921
6-[4-[(5-chloro-2-pyridinyl)methyl]piperazin-1-yl]-3-phenyl-[1,2,4]triazolo[4,3-b]pyridazine
CID 133465557
6-[4-(pyridin-2-ylmethyl)-1,4-diazepan-1-yl]-3-(trifluoromethyl)-[1,2,4]triazolo[4,3-b]pyridazine
CID 138989106
1-phenyl-4-(pyridin-2-ylmethyl)piperazine
CID 1090338
5-methyl-2,4-bis[4-(pyridin-2-ylmethyl)piperazin-1-yl]pyrimidine
CID 133349095
1-(3,5-dimethyl-1-phenylpyrazol-4-yl)-4-(pyridin-2-ylmethyl)piperazine
CID 90507607
1-[4-[4-(pyridin-2-ylmethyl)piperazin-1-yl]pyrimidin-2-yl]ethanol
CID 22328845
1-(3,5-dimethyl-1-pyridin-2-ylpyrazol-4-yl)-4-(pyridin-2-ylmethyl)piperazine
CID 90508074
1-[(1,3-diphenylpyrazol-4-yl)methyl]-4-(pyridin-2-ylmethyl)piperazine
CID 16576279
1-(4-methoxyphenyl)-4-(pyridin-2-ylmethyl)piperazine
CID 134032862
2-[4-[(1-methyl-2-phenylimidazol-4-yl)methyl]piperazin-1-yl]pyrimidine
CID 10308727

Frequently Asked Questions

What is the IUPAC name of 3-methyl-2-phenyl-6-[4-(pyridin-2-ylmethyl)piperazin-1-yl]imidazo[1,2-b]pyridazine?
The IUPAC name of 3-methyl-2-phenyl-6-[4-(pyridin-2-ylmethyl)piperazin-1-yl]imidazo[1,2-b]pyridazine (CID 67983035) is 3-methyl-2-phenyl-6-[4-(pyridin-2-ylmethyl)piperazin-1-yl]imidazo[1,2-b]pyridazine.
What is the SMILES notation for 3-methyl-2-phenyl-6-[4-(pyridin-2-ylmethyl)piperazin-1-yl]imidazo[1,2-b]pyridazine?
The canonical SMILES for 3-methyl-2-phenyl-6-[4-(pyridin-2-ylmethyl)piperazin-1-yl]imidazo[1,2-b]pyridazine is Cc1c(-c2ccccc2)nc2ccc(N3CCN(Cc4ccccn4)CC3)nn12.
What is the InChIKey of 3-methyl-2-phenyl-6-[4-(pyridin-2-ylmethyl)piperazin-1-yl]imidazo[1,2-b]pyridazine?
The InChIKey is AYYSCWRFSGHMBN-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H24N6/c1-18-23(19-7-3-2-4-8-19)25-21-10-11-22(26-29(18)21)28-15-13-27(14-16-28)17-20-9-5-6-12-24-20/h2-12H,13-17H2,1H3.
What are the key properties of 3-methyl-2-phenyl-6-[4-(pyridin-2-ylmethyl)piperazin-1-yl]imidazo[1,2-b]pyridazine?
3-methyl-2-phenyl-6-[4-(pyridin-2-ylmethyl)piperazin-1-yl]imidazo[1,2-b]pyridazine has a molecular weight of 384.49 g/mol, XLogP of 3.42, 4 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-2-phenyl-6-[4-(pyridin-2-ylmethyl)piperazin-1-yl]imidazo[1,2-b]pyridazine is sourced from PubChem (CID 67983035), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).