N-benzyl-2-[4-(tetrazolo[1,5-b]pyridazin-6-yl)piperazin-1-yl]acetamide

C17H20N8O — CID 24607580

IUPACN-benzyl-2-[4-(tetrazolo[1,5-b]pyridazin-6-yl)piperazin-1-yl]acetamide
SMILESO=C(CN1CCN(c2ccc3nnnn3n2)CC1)NCc1ccccc1
InChIInChI=1S/C17H20N8O/c26-17(18-12-14-4-2-1-3-5-14)13-23-8-10-24(11-9-23)16-7-6-15-19-21-22-25(15)20-16/h1-7H,8-13H2,(H,18,26)
InChIKeyZUGXJIIMNLYOQS-UHFFFAOYSA-N
MW352.40 g/mol
LogP-0.04
Rot. Bonds5

About N-benzyl-2-[4-(tetrazolo[1,5-b]pyridazin-6-yl)piperazin-1-yl]acetamide

N-benzyl-2-[4-(tetrazolo[1,5-b]pyridazin-6-yl)piperazin-1-yl]acetamide (PubChem CID 24607580) has the molecular formula C17H20N8O and a molecular weight of 352.40 g/mol. Its IUPAC name is N-benzyl-2-[4-(tetrazolo[1,5-b]pyridazin-6-yl)piperazin-1-yl]acetamide.

Molecular Properties

Compound NameN-benzyl-2-[4-(tetrazolo[1,5-b]pyridazin-6-yl)piperazin-1-yl]acetamide
PubChem CID24607580
Molecular FormulaC17H20N8O
Molecular Weight352.40 g/mol
Exact Mass352.18
IUPAC NameN-benzyl-2-[4-(tetrazolo[1,5-b]pyridazin-6-yl)piperazin-1-yl]acetamide
SMILESO=C(CN1CCN(c2ccc3nnnn3n2)CC1)NCc1ccccc1
InChIInChI=1S/C17H20N8O/c26-17(18-12-14-4-2-1-3-5-14)13-23-8-10-24(11-9-23)16-7-6-15-19-21-22-25(15)20-16/h1-7H,8-13H2,(H,18,26)
InChIKeyZUGXJIIMNLYOQS-UHFFFAOYSA-N
XLogP-0.04
TPSA91.55 Ų
H-Bond Donors1
H-Bond Acceptors8
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500352.40
LogP ≤ 5-0.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 108

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Related Compounds

N-butan-2-yl-2-[4-(tetrazolo[1,5-b]pyridazin-6-yl)piperazin-1-yl]acetamide
CID 42949565
N-(4-chlorophenyl)-2-[4-(tetrazolo[1,5-b]pyridazin-6-yl)piperazin-1-yl]acetamide
CID 133418047
N-benzyl-2-[4-(1-phenyltetrazol-5-yl)piperazin-1-yl]acetamide
CID 26041068
N-benzyl-2-[4-(3-thiophen-3-yl-[1,2,4]triazolo[4,3-b]pyridazin-6-yl)piperazin-1-yl]acetamide
CID 133489045
N-benzyl-2-(4-pyrimidin-4-ylpiperazin-1-yl)acetamide
CID 75391386
6-(4-phenylpiperazin-1-yl)tetrazolo[1,5-b]pyridazine
CID 685555
N-benzyl-2-[4-(4-methylquinolin-2-yl)piperazin-1-yl]acetamide
CID 51323012
N-benzyl-2-[4-(1-chloroisoquinolin-3-yl)piperazin-1-yl]acetamide
CID 134006985
N-benzyl-2-[4-[2-[4-(tetrazol-1-yl)phenyl]acetyl]piperazin-1-yl]acetamide
CID 55651949
N-[(4-tert-butylphenyl)methyl]-1-(tetrazolo[1,5-b]pyridazin-6-yl)piperidine-4-carboxamide
CID 166198550
N-benzyl-2-[4-(2,3-dimethylphenyl)piperazin-1-yl]acetamide
CID 6469246
2-fluoro-N-[4-methyl-1-(tetrazolo[1,5-b]pyridazin-6-yl)piperidin-4-yl]-3-phenylpropanamide
CID 167847338

Frequently Asked Questions

What is the IUPAC name of N-benzyl-2-[4-(tetrazolo[1,5-b]pyridazin-6-yl)piperazin-1-yl]acetamide?
The IUPAC name of N-benzyl-2-[4-(tetrazolo[1,5-b]pyridazin-6-yl)piperazin-1-yl]acetamide (CID 24607580) is N-benzyl-2-[4-(tetrazolo[1,5-b]pyridazin-6-yl)piperazin-1-yl]acetamide.
What is the SMILES notation for N-benzyl-2-[4-(tetrazolo[1,5-b]pyridazin-6-yl)piperazin-1-yl]acetamide?
The canonical SMILES for N-benzyl-2-[4-(tetrazolo[1,5-b]pyridazin-6-yl)piperazin-1-yl]acetamide is O=C(CN1CCN(c2ccc3nnnn3n2)CC1)NCc1ccccc1.
What is the InChIKey of N-benzyl-2-[4-(tetrazolo[1,5-b]pyridazin-6-yl)piperazin-1-yl]acetamide?
The InChIKey is ZUGXJIIMNLYOQS-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N8O/c26-17(18-12-14-4-2-1-3-5-14)13-23-8-10-24(11-9-23)16-7-6-15-19-21-22-25(15)20-16/h1-7H,8-13H2,(H,18,26).
What are the key properties of N-benzyl-2-[4-(tetrazolo[1,5-b]pyridazin-6-yl)piperazin-1-yl]acetamide?
N-benzyl-2-[4-(tetrazolo[1,5-b]pyridazin-6-yl)piperazin-1-yl]acetamide has a molecular weight of 352.40 g/mol, XLogP of -0.04, 5 rotatable bonds, 1 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-2-[4-(tetrazolo[1,5-b]pyridazin-6-yl)piperazin-1-yl]acetamide is sourced from PubChem (CID 24607580), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).