1-(6-methyl-2-pyridinyl)piperazine;dihydrochloride

C10H17Cl2N3 — CID 3078152

IUPAC1-(6-methyl-2-pyridinyl)piperazine;dihydrochloride
SMILESCc1cccc(N2CCNCC2)n1.Cl.Cl
InChIInChI=1S/C10H15N3.2ClH/c1-9-3-2-4-10(12-9)13-7-5-11-6-8-13;;/h2-4,11H,5-8H2,1H3;2*1H
InChIKeyRWWHBYXYSIXAIH-UHFFFAOYSA-N
MW250.17 g/mol
LogP1.64
Rot. Bonds1

About 1-(6-methyl-2-pyridinyl)piperazine;dihydrochloride

1-(6-methyl-2-pyridinyl)piperazine;dihydrochloride (PubChem CID 3078152) has the molecular formula C10H17Cl2N3 and a molecular weight of 250.17 g/mol. Its IUPAC name is 1-(6-methyl-2-pyridinyl)piperazine;dihydrochloride.

Molecular Properties

Compound Name1-(6-methyl-2-pyridinyl)piperazine;dihydrochloride
PubChem CID3078152
Molecular FormulaC10H17Cl2N3
Molecular Weight250.17 g/mol
Exact Mass249.08
IUPAC Name1-(6-methyl-2-pyridinyl)piperazine;dihydrochloride
SMILESCc1cccc(N2CCNCC2)n1.Cl.Cl
InChIInChI=1S/C10H15N3.2ClH/c1-9-3-2-4-10(12-9)13-7-5-11-6-8-13;;/h2-4,11H,5-8H2,1H3;2*1H
InChIKeyRWWHBYXYSIXAIH-UHFFFAOYSA-N
XLogP1.64
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.17
LogP ≤ 51.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(6-methyl-2-pyridinyl)piperazine;dihydrochloride?
The IUPAC name of 1-(6-methyl-2-pyridinyl)piperazine;dihydrochloride (CID 3078152) is 1-(6-methyl-2-pyridinyl)piperazine;dihydrochloride.
What is the SMILES notation for 1-(6-methyl-2-pyridinyl)piperazine;dihydrochloride?
The canonical SMILES for 1-(6-methyl-2-pyridinyl)piperazine;dihydrochloride is Cc1cccc(N2CCNCC2)n1.Cl.Cl.
What is the InChIKey of 1-(6-methyl-2-pyridinyl)piperazine;dihydrochloride?
The InChIKey is RWWHBYXYSIXAIH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N3.2ClH/c1-9-3-2-4-10(12-9)13-7-5-11-6-8-13;;/h2-4,11H,5-8H2,1H3;2*1H.
What are the key properties of 1-(6-methyl-2-pyridinyl)piperazine;dihydrochloride?
1-(6-methyl-2-pyridinyl)piperazine;dihydrochloride has a molecular weight of 250.17 g/mol, XLogP of 1.64, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(6-methyl-2-pyridinyl)piperazine;dihydrochloride is sourced from PubChem (CID 3078152), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).