[1-(6-pyridin-2-ylpyridazin-3-yl)piperidin-3-yl]methanamine

C15H19N5 — CID 116972449

IUPAC[1-(6-pyridin-2-ylpyridazin-3-yl)piperidin-3-yl]methanamine
SMILESNCC1CCCN(c2ccc(-c3ccccn3)nn2)C1
InChIInChI=1S/C15H19N5/c16-10-12-4-3-9-20(11-12)15-7-6-14(18-19-15)13-5-1-2-8-17-13/h1-2,5-8,12H,3-4,9-11,16H2
InChIKeyNUDCPAQJHQNADC-UHFFFAOYSA-N
MW269.35 g/mol
LogP1.71
Rot. Bonds3

About [1-(6-pyridin-2-ylpyridazin-3-yl)piperidin-3-yl]methanamine

[1-(6-pyridin-2-ylpyridazin-3-yl)piperidin-3-yl]methanamine (PubChem CID 116972449) has the molecular formula C15H19N5 and a molecular weight of 269.35 g/mol. Its IUPAC name is [1-(6-pyridin-2-ylpyridazin-3-yl)piperidin-3-yl]methanamine.

Molecular Properties

Compound Name[1-(6-pyridin-2-ylpyridazin-3-yl)piperidin-3-yl]methanamine
PubChem CID116972449
Molecular FormulaC15H19N5
Molecular Weight269.35 g/mol
Exact Mass269.16
IUPAC Name[1-(6-pyridin-2-ylpyridazin-3-yl)piperidin-3-yl]methanamine
SMILESNCC1CCCN(c2ccc(-c3ccccn3)nn2)C1
InChIInChI=1S/C15H19N5/c16-10-12-4-3-9-20(11-12)15-7-6-14(18-19-15)13-5-1-2-8-17-13/h1-2,5-8,12H,3-4,9-11,16H2
InChIKeyNUDCPAQJHQNADC-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-3-ylpyridazin-3-yl)piperidin-3-yl]methanamine
CID 116972450
[1-(4-pyridin-2-ylpyrimidin-2-yl)piperidin-3-yl]methanamine
CID 103278821
3-(4-methylsulfonylpiperazin-1-yl)-6-pyridin-2-ylpyridazine
CID 25283779
(3R)-1-[6-(2-chlorophenyl)pyridazin-3-yl]piperidin-3-amine
CID 95361082
9-cyclobutyl-3-(6-pyridin-2-ylpyridazin-3-yl)-3,9-diazaspiro[5.5]undecane
CID 59818869
[(3R)-1-(6-methylpyridazin-3-yl)pyrrolidin-3-yl]methanamine
CID 94342238
[1-[6-(1H-pyrrol-3-yl)pyridazin-3-yl]pyrrolidin-3-yl]methanamine
CID 116972994
2-benzyl-5-(6-pyridin-2-ylpyridazin-3-yl)-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrole
CID 91812123
[(3S)-1-(6-chloropyridazin-3-yl)pyrrolidin-3-yl]methanamine
CID 94342103
(1-pyridin-3-ylpiperidin-3-yl)methanamine
CID 83818099
6-[[(3R)-1-pyridin-2-ylpiperidin-3-yl]methyl]pyridazin-3-amine
CID 95847067
3-methyl-1-[4-(6-pyridin-2-ylpyridazin-3-yl)piperazin-1-yl]butan-1-one
CID 25283703

Frequently Asked Questions

What is the IUPAC name of [1-(6-pyridin-2-ylpyridazin-3-yl)piperidin-3-yl]methanamine?
The IUPAC name of [1-(6-pyridin-2-ylpyridazin-3-yl)piperidin-3-yl]methanamine (CID 116972449) is [1-(6-pyridin-2-ylpyridazin-3-yl)piperidin-3-yl]methanamine.
What is the SMILES notation for [1-(6-pyridin-2-ylpyridazin-3-yl)piperidin-3-yl]methanamine?
The canonical SMILES for [1-(6-pyridin-2-ylpyridazin-3-yl)piperidin-3-yl]methanamine is NCC1CCCN(c2ccc(-c3ccccn3)nn2)C1.
What is the InChIKey of [1-(6-pyridin-2-ylpyridazin-3-yl)piperidin-3-yl]methanamine?
The InChIKey is NUDCPAQJHQNADC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N5/c16-10-12-4-3-9-20(11-12)15-7-6-14(18-19-15)13-5-1-2-8-17-13/h1-2,5-8,12H,3-4,9-11,16H2.
What are the key properties of [1-(6-pyridin-2-ylpyridazin-3-yl)piperidin-3-yl]methanamine?
[1-(6-pyridin-2-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-2-ylpyridazin-3-yl)piperidin-3-yl]methanamine is sourced from PubChem (CID 116972449), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).