2-[4-[6-(2-methylpropyl)pyridazin-3-yl]piperazin-1-yl]ethanamine

C14H25N5 — CID 116972594

IUPAC2-[4-[6-(2-methylpropyl)pyridazin-3-yl]piperazin-1-yl]ethanamine
SMILESCC(C)Cc1ccc(N2CCN(CCN)CC2)nn1
InChIInChI=1S/C14H25N5/c1-12(2)11-13-3-4-14(17-16-13)19-9-7-18(6-5-15)8-10-19/h3-4,12H,5-11,15H2,1-2H3
InChIKeyQWHGXCPWKSVTAO-UHFFFAOYSA-N
MW263.39 g/mol
LogP0.76
Rot. Bonds5

About 2-[4-[6-(2-methylpropyl)pyridazin-3-yl]piperazin-1-yl]ethanamine

2-[4-[6-(2-methylpropyl)pyridazin-3-yl]piperazin-1-yl]ethanamine (PubChem CID 116972594) has the molecular formula C14H25N5 and a molecular weight of 263.39 g/mol. Its IUPAC name is 2-[4-[6-(2-methylpropyl)pyridazin-3-yl]piperazin-1-yl]ethanamine.

Molecular Properties

Compound Name2-[4-[6-(2-methylpropyl)pyridazin-3-yl]piperazin-1-yl]ethanamine
PubChem CID116972594
Molecular FormulaC14H25N5
Molecular Weight263.39 g/mol
Exact Mass263.21
IUPAC Name2-[4-[6-(2-methylpropyl)pyridazin-3-yl]piperazin-1-yl]ethanamine
SMILESCC(C)Cc1ccc(N2CCN(CCN)CC2)nn1
InChIInChI=1S/C14H25N5/c1-12(2)11-13-3-4-14(17-16-13)19-9-7-18(6-5-15)8-10-19/h3-4,12H,5-11,15H2,1-2H3
InChIKeyQWHGXCPWKSVTAO-UHFFFAOYSA-N
XLogP0.76
TPSA58.28 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.39
LogP ≤ 50.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

[6-(4-propylpiperazin-1-yl)pyridazin-3-yl]methanamine
CID 55054734
1-[6-(2-methylpropyl)pyridazin-3-yl]-1,4-diazepane
CID 116972621
[4-[6-(2-methylpropyl)pyridazin-3-yl]morpholin-2-yl]methanamine
CID 116972571
N-methyl-1-[6-[4-(2-methylpropyl)piperazin-1-yl]pyridazin-3-yl]methanamine
CID 62777120
[6-[4-(2,2,2-trifluoroethyl)piperazin-1-yl]pyridazin-3-yl]methanamine
CID 62968966
3-[4-(3-methylbutyl)piperazin-1-yl]-6-methylsulfanylpyridazine
CID 56786373
[4-[6-(2-methylpropyl)pyridazin-3-yl]morpholin-3-yl]methanamine
CID 116972580
2-methyl-3-[4-(6-methylpyridazin-3-yl)piperazin-1-yl]propan-1-amine
CID 61312903
2-[4-(5-bromo-2-pyridinyl)piperazin-1-yl]ethanamine
CID 60869692
2-[6-(2-methylpropyl)pyridazin-3-yl]-2,7-diazaspiro[4.4]nonane
CID 116973150
N-[[6-(4-ethylpiperazin-1-yl)pyridazin-3-yl]methyl]ethanamine
CID 62279640
2-(4-pyridin-2-ylpiperazin-1-yl)ethanamine;tetrahydrochloride
CID 23627586

Frequently Asked Questions

What is the IUPAC name of 2-[4-[6-(2-methylpropyl)pyridazin-3-yl]piperazin-1-yl]ethanamine?
The IUPAC name of 2-[4-[6-(2-methylpropyl)pyridazin-3-yl]piperazin-1-yl]ethanamine (CID 116972594) is 2-[4-[6-(2-methylpropyl)pyridazin-3-yl]piperazin-1-yl]ethanamine.
What is the SMILES notation for 2-[4-[6-(2-methylpropyl)pyridazin-3-yl]piperazin-1-yl]ethanamine?
The canonical SMILES for 2-[4-[6-(2-methylpropyl)pyridazin-3-yl]piperazin-1-yl]ethanamine is CC(C)Cc1ccc(N2CCN(CCN)CC2)nn1.
What is the InChIKey of 2-[4-[6-(2-methylpropyl)pyridazin-3-yl]piperazin-1-yl]ethanamine?
The InChIKey is QWHGXCPWKSVTAO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25N5/c1-12(2)11-13-3-4-14(17-16-13)19-9-7-18(6-5-15)8-10-19/h3-4,12H,5-11,15H2,1-2H3.
What are the key properties of 2-[4-[6-(2-methylpropyl)pyridazin-3-yl]piperazin-1-yl]ethanamine?
2-[4-[6-(2-methylpropyl)pyridazin-3-yl]piperazin-1-yl]ethanamine has a molecular weight of 263.39 g/mol, XLogP of 0.76, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-[6-(2-methylpropyl)pyridazin-3-yl]piperazin-1-yl]ethanamine is sourced from PubChem (CID 116972594), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).