1-pyridazin-3-ylpiperidin-3-amine

C9H14N4 — CID 54593919

IUPAC1-pyridazin-3-ylpiperidin-3-amine
SMILESNC1CCCN(c2cccnn2)C1
InChIInChI=1S/C9H14N4/c10-8-3-2-6-13(7-8)9-4-1-5-11-12-9/h1,4-5,8H,2-3,6-7,10H2
InChIKeyHTGWIKVWARFXLJ-UHFFFAOYSA-N
MW178.24 g/mol
LogP0.40
Rot. Bonds1

About 1-pyridazin-3-ylpiperidin-3-amine

1-pyridazin-3-ylpiperidin-3-amine (PubChem CID 54593919) has the molecular formula C9H14N4 and a molecular weight of 178.24 g/mol. Its IUPAC name is 1-pyridazin-3-ylpiperidin-3-amine.

Molecular Properties

Compound Name1-pyridazin-3-ylpiperidin-3-amine
PubChem CID54593919
Molecular FormulaC9H14N4
Molecular Weight178.24 g/mol
Exact Mass178.12
IUPAC Name1-pyridazin-3-ylpiperidin-3-amine
SMILESNC1CCCN(c2cccnn2)C1
InChIInChI=1S/C9H14N4/c10-8-3-2-6-13(7-8)9-4-1-5-11-12-9/h1,4-5,8H,2-3,6-7,10H2
InChIKeyHTGWIKVWARFXLJ-UHFFFAOYSA-N
XLogP0.40
TPSA55.04 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500178.24
LogP ≤ 50.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-pyridazin-3-ylpiperidine-3-carbaldehyde
CID 62664168
(3S)-1-(6-chloropyridazin-3-yl)piperidin-3-amine
CID 86318137
[(3R)-1-pyridazin-3-ylpyrrolidin-3-yl]methanol
CID 130626069
3-(3-pyrrolidin-2-ylpiperidin-1-yl)pyridazine
CID 62484087
N-methyl-1-pyridazin-3-ylpiperidine-3-carboxamide
CID 110269425
(3R)-N-methyl-1-pyridazin-3-ylpyrrolidin-3-amine
CID 177337485
3-amino-N,2-dimethyl-N-(1-pyridazin-3-ylpiperidin-3-yl)butanamide
CID 120503791
1-([1,2,4]triazolo[4,3-b]pyridazin-6-yl)piperidin-3-amine
CID 131631786
(3R)-1-[6-(2-chlorophenyl)pyridazin-3-yl]piperidin-3-amine
CID 95361082
1-[6-(2-methylphenyl)pyridazin-3-yl]piperidin-3-amine
CID 56770727
3-[4-(chloromethyl)piperidin-1-yl]pyridazine
CID 63390374
ethane;8-methyl-3-pyridazin-3-yl-3,8-diazabicyclo[3.2.1]octane
CID 91579782

Frequently Asked Questions

What is the IUPAC name of 1-pyridazin-3-ylpiperidin-3-amine?
The IUPAC name of 1-pyridazin-3-ylpiperidin-3-amine (CID 54593919) is 1-pyridazin-3-ylpiperidin-3-amine.
What is the SMILES notation for 1-pyridazin-3-ylpiperidin-3-amine?
The canonical SMILES for 1-pyridazin-3-ylpiperidin-3-amine is NC1CCCN(c2cccnn2)C1.
What is the InChIKey of 1-pyridazin-3-ylpiperidin-3-amine?
The InChIKey is HTGWIKVWARFXLJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14N4/c10-8-3-2-6-13(7-8)9-4-1-5-11-12-9/h1,4-5,8H,2-3,6-7,10H2.
What are the key properties of 1-pyridazin-3-ylpiperidin-3-amine?
1-pyridazin-3-ylpiperidin-3-amine has a molecular weight of 178.24 g/mol, XLogP of 0.40, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-pyridazin-3-ylpiperidin-3-amine is sourced from PubChem (CID 54593919), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).