[3,5-dichloro-6-(2,3,5-trimethylpiperidin-1-yl)-2-pyridinyl]hydrazine

C13H20Cl2N4 — CID 102762649

IUPAC[3,5-dichloro-6-(2,3,5-trimethylpiperidin-1-yl)-2-pyridinyl]hydrazine
SMILESCC1CC(C)C(C)N(c2nc(NN)c(Cl)cc2Cl)C1
InChIInChI=1S/C13H20Cl2N4/c1-7-4-8(2)9(3)19(6-7)13-11(15)5-10(14)12(17-13)18-16/h5,7-9H,4,6,16H2,1-3H3,(H,17,18)
InChIKeyTUXPYMVTRKROMH-UHFFFAOYSA-N
MW303.24 g/mol
LogP3.54
Rot. Bonds2

About [3,5-dichloro-6-(2,3,5-trimethylpiperidin-1-yl)-2-pyridinyl]hydrazine

[3,5-dichloro-6-(2,3,5-trimethylpiperidin-1-yl)-2-pyridinyl]hydrazine (PubChem CID 102762649) has the molecular formula C13H20Cl2N4 and a molecular weight of 303.24 g/mol. Its IUPAC name is [3,5-dichloro-6-(2,3,5-trimethylpiperidin-1-yl)-2-pyridinyl]hydrazine.

Molecular Properties

Compound Name[3,5-dichloro-6-(2,3,5-trimethylpiperidin-1-yl)-2-pyridinyl]hydrazine
PubChem CID102762649
Molecular FormulaC13H20Cl2N4
Molecular Weight303.24 g/mol
Exact Mass302.11
IUPAC Name[3,5-dichloro-6-(2,3,5-trimethylpiperidin-1-yl)-2-pyridinyl]hydrazine
SMILESCC1CC(C)C(C)N(c2nc(NN)c(Cl)cc2Cl)C1
InChIInChI=1S/C13H20Cl2N4/c1-7-4-8(2)9(3)19(6-7)13-11(15)5-10(14)12(17-13)18-16/h5,7-9H,4,6,16H2,1-3H3,(H,17,18)
InChIKeyTUXPYMVTRKROMH-UHFFFAOYSA-N
XLogP3.54
TPSA54.18 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.24
LogP ≤ 53.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of [3,5-dichloro-6-(2,3,5-trimethylpiperidin-1-yl)-2-pyridinyl]hydrazine?
The IUPAC name of [3,5-dichloro-6-(2,3,5-trimethylpiperidin-1-yl)-2-pyridinyl]hydrazine (CID 102762649) is [3,5-dichloro-6-(2,3,5-trimethylpiperidin-1-yl)-2-pyridinyl]hydrazine.
What is the SMILES notation for [3,5-dichloro-6-(2,3,5-trimethylpiperidin-1-yl)-2-pyridinyl]hydrazine?
The canonical SMILES for [3,5-dichloro-6-(2,3,5-trimethylpiperidin-1-yl)-2-pyridinyl]hydrazine is CC1CC(C)C(C)N(c2nc(NN)c(Cl)cc2Cl)C1.
What is the InChIKey of [3,5-dichloro-6-(2,3,5-trimethylpiperidin-1-yl)-2-pyridinyl]hydrazine?
The InChIKey is TUXPYMVTRKROMH-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20Cl2N4/c1-7-4-8(2)9(3)19(6-7)13-11(15)5-10(14)12(17-13)18-16/h5,7-9H,4,6,16H2,1-3H3,(H,17,18).
What are the key properties of [3,5-dichloro-6-(2,3,5-trimethylpiperidin-1-yl)-2-pyridinyl]hydrazine?
[3,5-dichloro-6-(2,3,5-trimethylpiperidin-1-yl)-2-pyridinyl]hydrazine has a molecular weight of 303.24 g/mol, XLogP of 3.54, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [3,5-dichloro-6-(2,3,5-trimethylpiperidin-1-yl)-2-pyridinyl]hydrazine is sourced from PubChem (CID 102762649), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).