6-[4-[[5-(oxolan-2-yl)thiophen-2-yl]methyl]piperazin-1-yl]imidazo[1,2-b]pyridazine

C19H23N5OS — CID 74246038

IUPAC6-[4-[[5-(oxolan-2-yl)thiophen-2-yl]methyl]piperazin-1-yl]imidazo[1,2-b]pyridazine
SMILESc1cn2nc(N3CCN(Cc4ccc(C5CCCO5)s4)CC3)ccc2n1
InChIInChI=1S/C19H23N5OS/c1-2-16(25-13-1)17-4-3-15(26-17)14-22-9-11-23(12-10-22)19-6-5-18-20-7-8-24(18)21-19/h3-8,16H,1-2,9-14H2
InChIKeyAVISTPMJXDOZDK-UHFFFAOYSA-N
MW369.49 g/mol
LogP2.96
Rot. Bonds4

About 6-[4-[[5-(oxolan-2-yl)thiophen-2-yl]methyl]piperazin-1-yl]imidazo[1,2-b]pyridazine

6-[4-[[5-(oxolan-2-yl)thiophen-2-yl]methyl]piperazin-1-yl]imidazo[1,2-b]pyridazine (PubChem CID 74246038) has the molecular formula C19H23N5OS and a molecular weight of 369.49 g/mol. Its IUPAC name is 6-[4-[[5-(oxolan-2-yl)thiophen-2-yl]methyl]piperazin-1-yl]imidazo[1,2-b]pyridazine.

Molecular Properties

Compound Name6-[4-[[5-(oxolan-2-yl)thiophen-2-yl]methyl]piperazin-1-yl]imidazo[1,2-b]pyridazine
PubChem CID74246038
Molecular FormulaC19H23N5OS
Molecular Weight369.49 g/mol
Exact Mass369.16
IUPAC Name6-[4-[[5-(oxolan-2-yl)thiophen-2-yl]methyl]piperazin-1-yl]imidazo[1,2-b]pyridazine
SMILESc1cn2nc(N3CCN(Cc4ccc(C5CCCO5)s4)CC3)ccc2n1
InChIInChI=1S/C19H23N5OS/c1-2-16(25-13-1)17-4-3-15(26-17)14-22-9-11-23(12-10-22)19-6-5-18-20-7-8-24(18)21-19/h3-8,16H,1-2,9-14H2
InChIKeyAVISTPMJXDOZDK-UHFFFAOYSA-N
XLogP2.96
TPSA45.90 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500369.49
LogP ≤ 52.96
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

Analyze 6-[4-[[5-(oxolan-2-yl)thiophen-2-yl]methyl]piperazin-1-yl]imidazo[1,2-b]pyridazine with MolForge

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Related Compounds

6-[4-[(5-bromothiophen-2-yl)methyl]piperazin-1-yl]imidazo[1,2-b]pyridazine
CID 71850453
1-[(1-methylimidazol-2-yl)methyl]-4-[[5-[(2R)-oxolan-2-yl]thiophen-2-yl]methyl]piperazine
CID 99951233
1-(3-methyl-2-pyridinyl)-4-[[5-[(2S)-oxolan-2-yl]thiophen-2-yl]methyl]piperazine
CID 95726464
1-(2-fluorophenyl)-4-[[5-(oxolan-2-yl)thiophen-2-yl]methyl]piperazine
CID 77084296
2,5-dimethyl-3-[4-[[5-[(2S)-oxolan-2-yl]thiophen-2-yl]methyl]piperazin-1-yl]pyrazine
CID 95143429
1-[(4-chlorophenyl)methyl]-4-[[5-[(2S)-oxolan-2-yl]thiophen-2-yl]methyl]piperazine
CID 95877254
3-[1-[[5-[(2S)-oxolan-2-yl]thiophen-2-yl]methyl]piperidin-4-yl]-[1,2,4]triazolo[4,3-a]pyridine
CID 99956248
1-imidazo[1,2-b]pyridazin-6-ylpiperidin-4-ol
CID 131704101
1-ethylsulfonyl-4-[[5-(oxolan-2-yl)thiophen-2-yl]methyl]piperazine
CID 131907476
6-piperidin-1-ylimidazo[1,2-b]pyridazine
CID 23657730
6-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]imidazo[1,2-b]pyridazine
CID 134310576
4-(1-imidazo[1,2-b]pyridazin-6-ylpiperidin-4-yl)morpholine
CID 171690270

Frequently Asked Questions

What is the IUPAC name of 6-[4-[[5-(oxolan-2-yl)thiophen-2-yl]methyl]piperazin-1-yl]imidazo[1,2-b]pyridazine?
The IUPAC name of 6-[4-[[5-(oxolan-2-yl)thiophen-2-yl]methyl]piperazin-1-yl]imidazo[1,2-b]pyridazine (CID 74246038) is 6-[4-[[5-(oxolan-2-yl)thiophen-2-yl]methyl]piperazin-1-yl]imidazo[1,2-b]pyridazine.
What is the SMILES notation for 6-[4-[[5-(oxolan-2-yl)thiophen-2-yl]methyl]piperazin-1-yl]imidazo[1,2-b]pyridazine?
The canonical SMILES for 6-[4-[[5-(oxolan-2-yl)thiophen-2-yl]methyl]piperazin-1-yl]imidazo[1,2-b]pyridazine is c1cn2nc(N3CCN(Cc4ccc(C5CCCO5)s4)CC3)ccc2n1.
What is the InChIKey of 6-[4-[[5-(oxolan-2-yl)thiophen-2-yl]methyl]piperazin-1-yl]imidazo[1,2-b]pyridazine?
The InChIKey is AVISTPMJXDOZDK-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23N5OS/c1-2-16(25-13-1)17-4-3-15(26-17)14-22-9-11-23(12-10-22)19-6-5-18-20-7-8-24(18)21-19/h3-8,16H,1-2,9-14H2.
What are the key properties of 6-[4-[[5-(oxolan-2-yl)thiophen-2-yl]methyl]piperazin-1-yl]imidazo[1,2-b]pyridazine?
6-[4-[[5-(oxolan-2-yl)thiophen-2-yl]methyl]piperazin-1-yl]imidazo[1,2-b]pyridazine has a molecular weight of 369.49 g/mol, XLogP of 2.96, 4 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[4-[[5-(oxolan-2-yl)thiophen-2-yl]methyl]piperazin-1-yl]imidazo[1,2-b]pyridazine is sourced from PubChem (CID 74246038), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).