2-methyl-N'-[6-(1-methylpiperidin-3-yl)pyridazin-3-yl]propane-1,3-diamine

C14H25N5 — CID 116970815

IUPAC2-methyl-N'-[6-(1-methylpiperidin-3-yl)pyridazin-3-yl]propane-1,3-diamine
SMILESCC(CN)CNc1ccc(C2CCCN(C)C2)nn1
InChIInChI=1S/C14H25N5/c1-11(8-15)9-16-14-6-5-13(17-18-14)12-4-3-7-19(2)10-12/h5-6,11-12H,3-4,7-10,15H2,1-2H3,(H,16,18)
InChIKeyMOTQXKSRQKAFIT-UHFFFAOYSA-N
MW263.39 g/mol
LogP1.29
Rot. Bonds5

About 2-methyl-N'-[6-(1-methylpiperidin-3-yl)pyridazin-3-yl]propane-1,3-diamine

2-methyl-N'-[6-(1-methylpiperidin-3-yl)pyridazin-3-yl]propane-1,3-diamine (PubChem CID 116970815) has the molecular formula C14H25N5 and a molecular weight of 263.39 g/mol. Its IUPAC name is 2-methyl-N'-[6-(1-methylpiperidin-3-yl)pyridazin-3-yl]propane-1,3-diamine.

Molecular Properties

Compound Name2-methyl-N'-[6-(1-methylpiperidin-3-yl)pyridazin-3-yl]propane-1,3-diamine
PubChem CID116970815
Molecular FormulaC14H25N5
Molecular Weight263.39 g/mol
Exact Mass263.21
IUPAC Name2-methyl-N'-[6-(1-methylpiperidin-3-yl)pyridazin-3-yl]propane-1,3-diamine
SMILESCC(CN)CNc1ccc(C2CCCN(C)C2)nn1
InChIInChI=1S/C14H25N5/c1-11(8-15)9-16-14-6-5-13(17-18-14)12-4-3-7-19(2)10-12/h5-6,11-12H,3-4,7-10,15H2,1-2H3,(H,16,18)
InChIKeyMOTQXKSRQKAFIT-UHFFFAOYSA-N
XLogP1.29
TPSA67.07 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.39
LogP ≤ 51.29
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

1-[[6-(1-methylpiperidin-3-yl)pyridazin-3-yl]amino]propan-2-one
CID 116972135
2-methyl-3-[4-(1-methylpiperidin-3-yl)pyrimidin-2-yl]propan-1-amine
CID 116898301
[1-[6-(1-methylpyrrolidin-3-yl)pyridazin-3-yl]pyrrolidin-2-yl]methanamine
CID 116973044
1-N-(6-cyclopentylpyridazin-3-yl)butane-1,3-diamine
CID 116970844
2-methyl-N'-[6-(4-methylphenyl)pyridazin-3-yl]propane-1,3-diamine
CID 116970792
N-ethyl-6-(1-methylpiperidin-4-yl)pyridazin-3-amine
CID 116973215
1-N-[5-(1-methylpiperidin-3-yl)pyrimidin-2-yl]propane-1,2-diamine
CID 116974333
6-(1-methylpiperidin-3-yl)pyridazine-3,4-diamine
CID 117105593
2-[4-methyl-6-(1-methylpiperidin-3-yl)pyrimidin-2-yl]propan-1-amine
CID 116892733
5-chloro-3-(1-methylpiperidin-3-yl)pyridazine
CID 117105599
[4-methyl-6-(1-methylpiperidin-3-yl)pyrimidin-2-yl]methanamine
CID 116892379
2-(1-methylpiperidin-3-yl)-5-(piperidin-1-ylmethyl)pyridine
CID 172524114

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N'-[6-(1-methylpiperidin-3-yl)pyridazin-3-yl]propane-1,3-diamine?
The IUPAC name of 2-methyl-N'-[6-(1-methylpiperidin-3-yl)pyridazin-3-yl]propane-1,3-diamine (CID 116970815) is 2-methyl-N'-[6-(1-methylpiperidin-3-yl)pyridazin-3-yl]propane-1,3-diamine.
What is the SMILES notation for 2-methyl-N'-[6-(1-methylpiperidin-3-yl)pyridazin-3-yl]propane-1,3-diamine?
The canonical SMILES for 2-methyl-N'-[6-(1-methylpiperidin-3-yl)pyridazin-3-yl]propane-1,3-diamine is CC(CN)CNc1ccc(C2CCCN(C)C2)nn1.
What is the InChIKey of 2-methyl-N'-[6-(1-methylpiperidin-3-yl)pyridazin-3-yl]propane-1,3-diamine?
The InChIKey is MOTQXKSRQKAFIT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25N5/c1-11(8-15)9-16-14-6-5-13(17-18-14)12-4-3-7-19(2)10-12/h5-6,11-12H,3-4,7-10,15H2,1-2H3,(H,16,18).
What are the key properties of 2-methyl-N'-[6-(1-methylpiperidin-3-yl)pyridazin-3-yl]propane-1,3-diamine?
2-methyl-N'-[6-(1-methylpiperidin-3-yl)pyridazin-3-yl]propane-1,3-diamine has a molecular weight of 263.39 g/mol, XLogP of 1.29, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N'-[6-(1-methylpiperidin-3-yl)pyridazin-3-yl]propane-1,3-diamine is sourced from PubChem (CID 116970815), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).