N-methyl-1-[6-[4-(2-methylpropyl)piperazin-1-yl]pyridazin-3-yl]methanamine

C14H25N5 — CID 62777120

IUPACN-methyl-1-[6-[4-(2-methylpropyl)piperazin-1-yl]pyridazin-3-yl]methanamine
SMILESCNCc1ccc(N2CCN(CC(C)C)CC2)nn1
InChIInChI=1S/C14H25N5/c1-12(2)11-18-6-8-19(9-7-18)14-5-4-13(10-15-3)16-17-14/h4-5,12,15H,6-11H2,1-3H3
InChIKeyAHMFSKHRASCDBW-UHFFFAOYSA-N
MW263.39 g/mol
LogP0.97
Rot. Bonds5

About N-methyl-1-[6-[4-(2-methylpropyl)piperazin-1-yl]pyridazin-3-yl]methanamine

N-methyl-1-[6-[4-(2-methylpropyl)piperazin-1-yl]pyridazin-3-yl]methanamine (PubChem CID 62777120) has the molecular formula C14H25N5 and a molecular weight of 263.39 g/mol. Its IUPAC name is N-methyl-1-[6-[4-(2-methylpropyl)piperazin-1-yl]pyridazin-3-yl]methanamine.

Molecular Properties

Compound NameN-methyl-1-[6-[4-(2-methylpropyl)piperazin-1-yl]pyridazin-3-yl]methanamine
PubChem CID62777120
Molecular FormulaC14H25N5
Molecular Weight263.39 g/mol
Exact Mass263.21
IUPAC NameN-methyl-1-[6-[4-(2-methylpropyl)piperazin-1-yl]pyridazin-3-yl]methanamine
SMILESCNCc1ccc(N2CCN(CC(C)C)CC2)nn1
InChIInChI=1S/C14H25N5/c1-12(2)11-18-6-8-19(9-7-18)14-5-4-13(10-15-3)16-17-14/h4-5,12,15H,6-11H2,1-3H3
InChIKeyAHMFSKHRASCDBW-UHFFFAOYSA-N
XLogP0.97
TPSA44.29 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 ≤ 50.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-[[6-(4-ethylpiperazin-1-yl)pyridazin-3-yl]methyl]ethanamine
CID 62279640
1-[6-(2,6-dimethylmorpholin-4-yl)pyridazin-3-yl]-N-methylmethanamine
CID 55054944
2-[4-[6-(2-methylpropyl)pyridazin-3-yl]piperazin-1-yl]ethanamine
CID 116972594
N-methyl-1-[6-(2,2,6,6-tetramethylmorpholin-4-yl)pyridazin-3-yl]methanamine
CID 102745903
N-[(6-morpholin-4-ylpyridazin-3-yl)methyl]propan-2-amine
CID 62284394
N-[[6-(4-propan-2-ylpiperazin-1-yl)pyridazin-3-yl]methyl]propan-1-amine
CID 62282587
2-methyl-3-[4-(6-methylpyridazin-3-yl)piperazin-1-yl]propan-1-amine
CID 61312903
N-[[6-[4-(2-methylpropyl)piperazin-1-yl]-2-pyridinyl]methyl]cyclopropanamine
CID 62776079
1-[6-(3-methoxy-3-methylpiperidin-1-yl)pyridazin-3-yl]-N-methylmethanamine
CID 107395284
[6-(4-propylpiperazin-1-yl)pyridazin-3-yl]methanamine
CID 55054734
N-methyl-1-[6-(3-propan-2-ylpyrazol-1-yl)pyridazin-3-yl]methanamine
CID 62491947
N-methyl-6-[4-(2-methylpropyl)piperazin-1-yl]pyrimidin-4-amine
CID 80825091

Frequently Asked Questions

What is the IUPAC name of N-methyl-1-[6-[4-(2-methylpropyl)piperazin-1-yl]pyridazin-3-yl]methanamine?
The IUPAC name of N-methyl-1-[6-[4-(2-methylpropyl)piperazin-1-yl]pyridazin-3-yl]methanamine (CID 62777120) is N-methyl-1-[6-[4-(2-methylpropyl)piperazin-1-yl]pyridazin-3-yl]methanamine.
What is the SMILES notation for N-methyl-1-[6-[4-(2-methylpropyl)piperazin-1-yl]pyridazin-3-yl]methanamine?
The canonical SMILES for N-methyl-1-[6-[4-(2-methylpropyl)piperazin-1-yl]pyridazin-3-yl]methanamine is CNCc1ccc(N2CCN(CC(C)C)CC2)nn1.
What is the InChIKey of N-methyl-1-[6-[4-(2-methylpropyl)piperazin-1-yl]pyridazin-3-yl]methanamine?
The InChIKey is AHMFSKHRASCDBW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25N5/c1-12(2)11-18-6-8-19(9-7-18)14-5-4-13(10-15-3)16-17-14/h4-5,12,15H,6-11H2,1-3H3.
What are the key properties of N-methyl-1-[6-[4-(2-methylpropyl)piperazin-1-yl]pyridazin-3-yl]methanamine?
N-methyl-1-[6-[4-(2-methylpropyl)piperazin-1-yl]pyridazin-3-yl]methanamine has a molecular weight of 263.39 g/mol, XLogP of 0.97, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-[6-[4-(2-methylpropyl)piperazin-1-yl]pyridazin-3-yl]methanamine is sourced from PubChem (CID 62777120), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).