6-chloro-4-piperidin-1-ylpyridazin-3-amine

C9H13ClN4 — CID 122508018

IUPAC6-chloro-4-piperidin-1-ylpyridazin-3-amine
SMILESNc1nnc(Cl)cc1N1CCCCC1
InChIInChI=1S/C9H13ClN4/c10-8-6-7(9(11)13-12-8)14-4-2-1-3-5-14/h6H,1-5H2,(H2,11,13)
InChIKeyGGJQLCJERGDRQH-UHFFFAOYSA-N
MW212.68 g/mol
LogP1.70
Rot. Bonds1

About 6-chloro-4-piperidin-1-ylpyridazin-3-amine

6-chloro-4-piperidin-1-ylpyridazin-3-amine (PubChem CID 122508018) has the molecular formula C9H13ClN4 and a molecular weight of 212.68 g/mol. Its IUPAC name is 6-chloro-4-piperidin-1-ylpyridazin-3-amine.

Molecular Properties

Compound Name6-chloro-4-piperidin-1-ylpyridazin-3-amine
PubChem CID122508018
Molecular FormulaC9H13ClN4
Molecular Weight212.68 g/mol
Exact Mass212.08
IUPAC Name6-chloro-4-piperidin-1-ylpyridazin-3-amine
SMILESNc1nnc(Cl)cc1N1CCCCC1
InChIInChI=1S/C9H13ClN4/c10-8-6-7(9(11)13-12-8)14-4-2-1-3-5-14/h6H,1-5H2,(H2,11,13)
InChIKeyGGJQLCJERGDRQH-UHFFFAOYSA-N
XLogP1.70
TPSA55.04 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.68
LogP ≤ 51.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

[1-(3-amino-6-chloropyridazin-4-yl)piperidin-4-yl]carbamic acid
CID 166708160
3-[4-(3-amino-6-chloropyridazin-4-yl)piperazin-1-yl]benzoic acid
CID 166643499
2-(azepan-1-yl)-4-chloroaniline
CID 79688976
tert-butyl 7-(3-amino-6-chloropyridazin-4-yl)-2,7-diazaspiro[3.5]nonane-2-carboxylate
CID 168901631
6-chloro-4-(8-phenyl-3,8-diazabicyclo[3.2.1]octan-3-yl)pyridazin-3-amine
CID 164578489
6-chloro-4-piperidin-1-ylpyridine-3-carbaldehyde
CID 115034801
3,6-dichloro-4-(4-methylpiperazin-1-yl)pyridazine
CID 537742
4-chloro-2-pyrrolidin-1-ylaniline
CID 58812033
3-[2-[4-(3-amino-6-chloropyridazin-4-yl)piperazin-1-yl]-4-pyridinyl]propanoic acid
CID 166643495
methyl 4-[1-(3-amino-6-chloropyridazin-4-yl)piperidin-3-yl]-3,5-difluorobenzoate
CID 176563101
methyl 4-[(3R)-1-(3-amino-6-chloropyridazin-4-yl)piperidin-3-yl]-3,5-difluorobenzoate
CID 178074036
4-(azocan-1-yl)-2-chloro-5-methylaniline
CID 113334138

Frequently Asked Questions

What is the IUPAC name of 6-chloro-4-piperidin-1-ylpyridazin-3-amine?
The IUPAC name of 6-chloro-4-piperidin-1-ylpyridazin-3-amine (CID 122508018) is 6-chloro-4-piperidin-1-ylpyridazin-3-amine.
What is the SMILES notation for 6-chloro-4-piperidin-1-ylpyridazin-3-amine?
The canonical SMILES for 6-chloro-4-piperidin-1-ylpyridazin-3-amine is Nc1nnc(Cl)cc1N1CCCCC1.
What is the InChIKey of 6-chloro-4-piperidin-1-ylpyridazin-3-amine?
The InChIKey is GGJQLCJERGDRQH-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13ClN4/c10-8-6-7(9(11)13-12-8)14-4-2-1-3-5-14/h6H,1-5H2,(H2,11,13).
What are the key properties of 6-chloro-4-piperidin-1-ylpyridazin-3-amine?
6-chloro-4-piperidin-1-ylpyridazin-3-amine has a molecular weight of 212.68 g/mol, XLogP of 1.70, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-4-piperidin-1-ylpyridazin-3-amine is sourced from PubChem (CID 122508018), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).