[6-(4-propylpiperazin-1-yl)pyridazin-3-yl]methanamine

C12H21N5 — CID 55054734

IUPAC[6-(4-propylpiperazin-1-yl)pyridazin-3-yl]methanamine
SMILESCCCN1CCN(c2ccc(CN)nn2)CC1
InChIInChI=1S/C12H21N5/c1-2-5-16-6-8-17(9-7-16)12-4-3-11(10-13)14-15-12/h3-4H,2,5-10,13H2,1H3
InChIKeyLJNWODCFLJEEOZ-UHFFFAOYSA-N
MW235.33 g/mol
LogP0.47
Rot. Bonds4

About [6-(4-propylpiperazin-1-yl)pyridazin-3-yl]methanamine

[6-(4-propylpiperazin-1-yl)pyridazin-3-yl]methanamine (PubChem CID 55054734) has the molecular formula C12H21N5 and a molecular weight of 235.33 g/mol. Its IUPAC name is [6-(4-propylpiperazin-1-yl)pyridazin-3-yl]methanamine.

Molecular Properties

Compound Name[6-(4-propylpiperazin-1-yl)pyridazin-3-yl]methanamine
PubChem CID55054734
Molecular FormulaC12H21N5
Molecular Weight235.33 g/mol
Exact Mass235.18
IUPAC Name[6-(4-propylpiperazin-1-yl)pyridazin-3-yl]methanamine
SMILESCCCN1CCN(c2ccc(CN)nn2)CC1
InChIInChI=1S/C12H21N5/c1-2-5-16-6-8-17(9-7-16)12-4-3-11(10-13)14-15-12/h3-4H,2,5-10,13H2,1H3
InChIKeyLJNWODCFLJEEOZ-UHFFFAOYSA-N
XLogP0.47
TPSA58.28 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.33
LogP ≤ 50.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

3-chloro-6-(4-propylpiperazin-1-yl)pyridazine
CID 43090208
[6-[4-(2,2,2-trifluoroethyl)piperazin-1-yl]pyridazin-3-yl]methanamine
CID 62968966
2-[4-[6-(2-methylpropyl)pyridazin-3-yl]piperazin-1-yl]ethanamine
CID 116972594
6-(4-propylpiperazin-1-yl)pyridine-3-carbothioamide
CID 24709307
[6-(4,4-dimethylazepan-1-yl)pyridazin-3-yl]methanamine
CID 65281689
N-[[6-(4-ethylpiperazin-1-yl)pyridazin-3-yl]methyl]ethanamine
CID 62279640
1-[6-(4-fluorophenyl)pyridazin-3-yl]-4-propyl-1,4-diazepane
CID 133314322
6-(4-propylpiperazin-1-yl)pyridin-2-amine
CID 69447331
2-[1-(6-propylpyridazin-3-yl)piperidin-4-yl]ethanamine
CID 116972543
[6-(2-ethylmorpholin-4-yl)pyridazin-3-yl]methanamine
CID 62284627
[6-(1,3-dihydroisoindol-2-yl)pyridazin-3-yl]methanamine
CID 62298749
[4-(4-propylpiperazin-1-yl)-3-pyridinyl]methanamine
CID 81248717

Frequently Asked Questions

What is the IUPAC name of [6-(4-propylpiperazin-1-yl)pyridazin-3-yl]methanamine?
The IUPAC name of [6-(4-propylpiperazin-1-yl)pyridazin-3-yl]methanamine (CID 55054734) is [6-(4-propylpiperazin-1-yl)pyridazin-3-yl]methanamine.
What is the SMILES notation for [6-(4-propylpiperazin-1-yl)pyridazin-3-yl]methanamine?
The canonical SMILES for [6-(4-propylpiperazin-1-yl)pyridazin-3-yl]methanamine is CCCN1CCN(c2ccc(CN)nn2)CC1.
What is the InChIKey of [6-(4-propylpiperazin-1-yl)pyridazin-3-yl]methanamine?
The InChIKey is LJNWODCFLJEEOZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H21N5/c1-2-5-16-6-8-17(9-7-16)12-4-3-11(10-13)14-15-12/h3-4H,2,5-10,13H2,1H3.
What are the key properties of [6-(4-propylpiperazin-1-yl)pyridazin-3-yl]methanamine?
[6-(4-propylpiperazin-1-yl)pyridazin-3-yl]methanamine has a molecular weight of 235.33 g/mol, XLogP of 0.47, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [6-(4-propylpiperazin-1-yl)pyridazin-3-yl]methanamine is sourced from PubChem (CID 55054734), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).