[1-(6-pyridin-3-ylpyridazin-3-yl)piperidin-3-yl]methanamine

C15H19N5 — CID 116972450

IUPAC[1-(6-pyridin-3-ylpyridazin-3-yl)piperidin-3-yl]methanamine
SMILESNCC1CCCN(c2ccc(-c3cccnc3)nn2)C1
InChIInChI=1S/C15H19N5/c16-9-12-3-2-8-20(11-12)15-6-5-14(18-19-15)13-4-1-7-17-10-13/h1,4-7,10,12H,2-3,8-9,11,16H2
InChIKeyMYCVNWUKLOGSLZ-UHFFFAOYSA-N
MW269.35 g/mol
LogP1.71
Rot. Bonds3

About [1-(6-pyridin-3-ylpyridazin-3-yl)piperidin-3-yl]methanamine

[1-(6-pyridin-3-ylpyridazin-3-yl)piperidin-3-yl]methanamine (PubChem CID 116972450) has the molecular formula C15H19N5 and a molecular weight of 269.35 g/mol. Its IUPAC name is [1-(6-pyridin-3-ylpyridazin-3-yl)piperidin-3-yl]methanamine.

Molecular Properties

Compound Name[1-(6-pyridin-3-ylpyridazin-3-yl)piperidin-3-yl]methanamine
PubChem CID116972450
Molecular FormulaC15H19N5
Molecular Weight269.35 g/mol
Exact Mass269.16
IUPAC Name[1-(6-pyridin-3-ylpyridazin-3-yl)piperidin-3-yl]methanamine
SMILESNCC1CCCN(c2ccc(-c3cccnc3)nn2)C1
InChIInChI=1S/C15H19N5/c16-9-12-3-2-8-20(11-12)15-6-5-14(18-19-15)13-4-1-7-17-10-13/h1,4-7,10,12H,2-3,8-9,11,16H2
InChIKeyMYCVNWUKLOGSLZ-UHFFFAOYSA-N
XLogP1.71
TPSA67.93 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.35
LogP ≤ 51.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

[1-(6-pyridin-2-ylpyridazin-3-yl)piperidin-3-yl]methanamine
CID 116972449
(1-pyridin-3-ylpiperidin-3-yl)methanamine
CID 83818099
2-[1-(6-pyridin-3-ylpyridazin-3-yl)pyrrolidin-2-yl]ethanamine
CID 116973081
N-(pyridin-3-ylmethyl)-1-(6-pyridin-3-ylpyridazin-3-yl)piperidine-3-carboxamide
CID 121070949
N-cyclohexyl-1-(6-pyridin-3-ylpyridazin-3-yl)piperidine-3-carboxamide
CID 121070976
N-[(2-chlorophenyl)methyl]-1-(6-pyridin-3-ylpyridazin-3-yl)piperidine-3-carboxamide
CID 121071054
[4-(4-fluorophenyl)piperazin-1-yl]-[1-(6-pyridin-3-ylpyridazin-3-yl)piperidin-3-yl]methanone
CID 121070942
N-(4-acetamidophenyl)-1-(6-pyridin-3-ylpyridazin-3-yl)piperidine-3-carboxamide
CID 121071100
N-[(4-methylphenyl)methyl]-1-(6-pyridin-3-ylpyridazin-3-yl)piperidine-3-carboxamide
CID 121071012
[1-[6-(1H-pyrrol-3-yl)pyridazin-3-yl]pyrrolidin-3-yl]methanamine
CID 116972994
(2-methyl-2,3-dihydroindol-1-yl)-[1-(6-pyridin-3-ylpyridazin-3-yl)piperidin-3-yl]methanone
CID 121070988
[4-(3-chloro-4-fluorophenyl)piperazin-1-yl]-[1-(6-pyridin-3-ylpyridazin-3-yl)piperidin-3-yl]methanone
CID 121071094

Frequently Asked Questions

What is the IUPAC name of [1-(6-pyridin-3-ylpyridazin-3-yl)piperidin-3-yl]methanamine?
The IUPAC name of [1-(6-pyridin-3-ylpyridazin-3-yl)piperidin-3-yl]methanamine (CID 116972450) is [1-(6-pyridin-3-ylpyridazin-3-yl)piperidin-3-yl]methanamine.
What is the SMILES notation for [1-(6-pyridin-3-ylpyridazin-3-yl)piperidin-3-yl]methanamine?
The canonical SMILES for [1-(6-pyridin-3-ylpyridazin-3-yl)piperidin-3-yl]methanamine is NCC1CCCN(c2ccc(-c3cccnc3)nn2)C1.
What is the InChIKey of [1-(6-pyridin-3-ylpyridazin-3-yl)piperidin-3-yl]methanamine?
The InChIKey is MYCVNWUKLOGSLZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N5/c16-9-12-3-2-8-20(11-12)15-6-5-14(18-19-15)13-4-1-7-17-10-13/h1,4-7,10,12H,2-3,8-9,11,16H2.
What are the key properties of [1-(6-pyridin-3-ylpyridazin-3-yl)piperidin-3-yl]methanamine?
[1-(6-pyridin-3-ylpyridazin-3-yl)piperidin-3-yl]methanamine has a molecular weight of 269.35 g/mol, XLogP of 1.71, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(6-pyridin-3-ylpyridazin-3-yl)piperidin-3-yl]methanamine is sourced from PubChem (CID 116972450), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).