[2-(3,4,5-trimethylpiperazin-1-yl)sulfonyl-3-pyridinyl]hydrazine

C12H21N5O2S — CID 103302119

IUPAC[2-(3,4,5-trimethylpiperazin-1-yl)sulfonyl-3-pyridinyl]hydrazine
SMILESCC1CN(S(=O)(=O)c2ncccc2NN)CC(C)N1C
InChIInChI=1S/C12H21N5O2S/c1-9-7-17(8-10(2)16(9)3)20(18,19)12-11(15-13)5-4-6-14-12/h4-6,9-10,15H,7-8,13H2,1-3H3
InChIKeyVXQJSRFNXJHWBM-UHFFFAOYSA-N
MW299.40 g/mol
LogP0.08
Rot. Bonds3

About [2-(3,4,5-trimethylpiperazin-1-yl)sulfonyl-3-pyridinyl]hydrazine

[2-(3,4,5-trimethylpiperazin-1-yl)sulfonyl-3-pyridinyl]hydrazine (PubChem CID 103302119) has the molecular formula C12H21N5O2S and a molecular weight of 299.40 g/mol. Its IUPAC name is [2-(3,4,5-trimethylpiperazin-1-yl)sulfonyl-3-pyridinyl]hydrazine.

Molecular Properties

Compound Name[2-(3,4,5-trimethylpiperazin-1-yl)sulfonyl-3-pyridinyl]hydrazine
PubChem CID103302119
Molecular FormulaC12H21N5O2S
Molecular Weight299.40 g/mol
Exact Mass299.14
IUPAC Name[2-(3,4,5-trimethylpiperazin-1-yl)sulfonyl-3-pyridinyl]hydrazine
SMILESCC1CN(S(=O)(=O)c2ncccc2NN)CC(C)N1C
InChIInChI=1S/C12H21N5O2S/c1-9-7-17(8-10(2)16(9)3)20(18,19)12-11(15-13)5-4-6-14-12/h4-6,9-10,15H,7-8,13H2,1-3H3
InChIKeyVXQJSRFNXJHWBM-UHFFFAOYSA-N
XLogP0.08
TPSA91.56 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.40
LogP ≤ 50.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

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Related Compounds

[2-(4-methylpiperidin-1-yl)sulfonyl-3-pyridinyl]hydrazine
CID 103300836
1-[(3-hydrazinyl-2-pyridinyl)sulfonyl]pyrrolidin-3-ol
CID 103301477
[2-(3-methoxy-4-methylpiperidin-1-yl)sulfonyl-3-pyridinyl]hydrazine
CID 103302177
[2-(4-ethoxypiperidin-1-yl)sulfonyl-3-pyridinyl]hydrazine
CID 103301047
[2-(4-cyclopropylpiperazin-1-yl)sulfonyl-3-pyridinyl]hydrazine
CID 103301085
[2-[4-(methoxymethyl)piperidin-1-yl]sulfonyl-3-pyridinyl]hydrazine
CID 103301600
[4-[(3-hydrazinyl-2-pyridinyl)sulfonyl]-6,6-dimethylmorpholin-2-yl]methanol
CID 103302124
3-hydrazinyl-N-[(1-propan-2-ylpyrrolidin-3-yl)methyl]pyridine-2-sulfonamide
CID 103301342
3-hydrazinyl-N-methyl-N-(1-methylpiperidin-4-yl)pyridine-2-sulfonamide
CID 103300879
[2-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-3-pyridinyl]hydrazine
CID 103300872
2-(3,4-dimethylpiperazin-1-yl)sulfonylpyridin-3-amine
CID 103306013
3-hydrazinyl-N,N-dimethylpyridine-2-sulfonamide
CID 103300835

Frequently Asked Questions

What is the IUPAC name of [2-(3,4,5-trimethylpiperazin-1-yl)sulfonyl-3-pyridinyl]hydrazine?
The IUPAC name of [2-(3,4,5-trimethylpiperazin-1-yl)sulfonyl-3-pyridinyl]hydrazine (CID 103302119) is [2-(3,4,5-trimethylpiperazin-1-yl)sulfonyl-3-pyridinyl]hydrazine.
What is the SMILES notation for [2-(3,4,5-trimethylpiperazin-1-yl)sulfonyl-3-pyridinyl]hydrazine?
The canonical SMILES for [2-(3,4,5-trimethylpiperazin-1-yl)sulfonyl-3-pyridinyl]hydrazine is CC1CN(S(=O)(=O)c2ncccc2NN)CC(C)N1C.
What is the InChIKey of [2-(3,4,5-trimethylpiperazin-1-yl)sulfonyl-3-pyridinyl]hydrazine?
The InChIKey is VXQJSRFNXJHWBM-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H21N5O2S/c1-9-7-17(8-10(2)16(9)3)20(18,19)12-11(15-13)5-4-6-14-12/h4-6,9-10,15H,7-8,13H2,1-3H3.
What are the key properties of [2-(3,4,5-trimethylpiperazin-1-yl)sulfonyl-3-pyridinyl]hydrazine?
[2-(3,4,5-trimethylpiperazin-1-yl)sulfonyl-3-pyridinyl]hydrazine has a molecular weight of 299.40 g/mol, XLogP of 0.08, 3 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(3,4,5-trimethylpiperazin-1-yl)sulfonyl-3-pyridinyl]hydrazine is sourced from PubChem (CID 103302119), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).