(3R)-1-[6-(2-chlorophenyl)pyridazin-3-yl]piperidin-3-amine

C15H17ClN4 — CID 95361082

IUPAC(3R)-1-[6-(2-chlorophenyl)pyridazin-3-yl]piperidin-3-amine
SMILESN[C@@H]1CCCN(c2ccc(-c3ccccc3Cl)nn2)C1
InChIInChI=1S/C15H17ClN4/c16-13-6-2-1-5-12(13)14-7-8-15(19-18-14)20-9-3-4-11(17)10-20/h1-2,5-8,11H,3-4,9-10,17H2/t11-/m1/s1
InChIKeyHDWMSUPKAQVECL-LLVKDONJSA-N
MW288.78 g/mol
LogP2.72
Rot. Bonds2

About (3R)-1-[6-(2-chlorophenyl)pyridazin-3-yl]piperidin-3-amine

(3R)-1-[6-(2-chlorophenyl)pyridazin-3-yl]piperidin-3-amine (PubChem CID 95361082) has the molecular formula C15H17ClN4 and a molecular weight of 288.78 g/mol. Its IUPAC name is (3R)-1-[6-(2-chlorophenyl)pyridazin-3-yl]piperidin-3-amine.

Molecular Properties

Compound Name(3R)-1-[6-(2-chlorophenyl)pyridazin-3-yl]piperidin-3-amine
PubChem CID95361082
Molecular FormulaC15H17ClN4
Molecular Weight288.78 g/mol
Exact Mass288.11
IUPAC Name(3R)-1-[6-(2-chlorophenyl)pyridazin-3-yl]piperidin-3-amine
SMILESN[C@@H]1CCCN(c2ccc(-c3ccccc3Cl)nn2)C1
InChIInChI=1S/C15H17ClN4/c16-13-6-2-1-5-12(13)14-7-8-15(19-18-14)20-9-3-4-11(17)10-20/h1-2,5-8,11H,3-4,9-10,17H2/t11-/m1/s1
InChIKeyHDWMSUPKAQVECL-LLVKDONJSA-N
XLogP2.72
TPSA55.04 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.78
LogP ≤ 52.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-[6-(2-methylphenyl)pyridazin-3-yl]piperidin-3-amine
CID 56770727
1-[6-(2-chlorophenyl)pyridazin-3-yl]pyrrolidin-3-ol
CID 3022107
(3S)-1-(6-chloropyridazin-3-yl)piperidin-3-amine
CID 86318137
2-[1-[6-(2-chlorophenyl)pyridazin-3-yl]piperidin-4-yl]acetamide
CID 136568304
1-[6-(2-chlorophenyl)pyridazin-3-yl]piperidine-4-carboxylic acid
CID 56770692
3,4-dichloro-N-[1-[6-(2-chlorophenyl)pyridazin-3-yl]piperidin-3-yl]benzamide
CID 175425958
1-[6-(5-methylfuran-2-yl)pyridazin-3-yl]piperidin-3-amine
CID 116972407
1-[6-(2-bromophenyl)pyridazin-3-yl]piperidin-3-ol
CID 116972807
1-pyridazin-3-ylpiperidin-3-amine
CID 54593919
[1-(6-pyridin-2-ylpyridazin-3-yl)piperidin-3-yl]methanamine
CID 116972449
(3S)-N-[(4-chlorophenyl)methyl]-1-[6-(2-methylphenyl)pyridazin-3-yl]piperidine-3-carboxamide
CID 30356026
1-[3-amino-6-(2-chlorophenyl)-2-pyridinyl]-2-[4-[(3S)-3-aminopiperidin-1-yl]-3-pyridinyl]ethanone
CID 149024931

Frequently Asked Questions

What is the IUPAC name of (3R)-1-[6-(2-chlorophenyl)pyridazin-3-yl]piperidin-3-amine?
The IUPAC name of (3R)-1-[6-(2-chlorophenyl)pyridazin-3-yl]piperidin-3-amine (CID 95361082) is (3R)-1-[6-(2-chlorophenyl)pyridazin-3-yl]piperidin-3-amine.
What is the SMILES notation for (3R)-1-[6-(2-chlorophenyl)pyridazin-3-yl]piperidin-3-amine?
The canonical SMILES for (3R)-1-[6-(2-chlorophenyl)pyridazin-3-yl]piperidin-3-amine is N[C@@H]1CCCN(c2ccc(-c3ccccc3Cl)nn2)C1.
What is the InChIKey of (3R)-1-[6-(2-chlorophenyl)pyridazin-3-yl]piperidin-3-amine?
The InChIKey is HDWMSUPKAQVECL-LLVKDONJSA-N. The full InChI is InChI=1S/C15H17ClN4/c16-13-6-2-1-5-12(13)14-7-8-15(19-18-14)20-9-3-4-11(17)10-20/h1-2,5-8,11H,3-4,9-10,17H2/t11-/m1/s1.
What are the key properties of (3R)-1-[6-(2-chlorophenyl)pyridazin-3-yl]piperidin-3-amine?
(3R)-1-[6-(2-chlorophenyl)pyridazin-3-yl]piperidin-3-amine has a molecular weight of 288.78 g/mol, XLogP of 2.72, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-1-[6-(2-chlorophenyl)pyridazin-3-yl]piperidin-3-amine is sourced from PubChem (CID 95361082), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).