[2-(4-ethoxypiperidin-1-yl)sulfonyl-3-pyridinyl]hydrazine

C12H20N4O3S — CID 103301047

IUPAC[2-(4-ethoxypiperidin-1-yl)sulfonyl-3-pyridinyl]hydrazine
SMILESCCOC1CCN(S(=O)(=O)c2ncccc2NN)CC1
InChIInChI=1S/C12H20N4O3S/c1-2-19-10-5-8-16(9-6-10)20(17,18)12-11(15-13)4-3-7-14-12/h3-4,7,10,15H,2,5-6,8-9,13H2,1H3
InChIKeyCPHQHMKKRMOQFS-UHFFFAOYSA-N
MW300.38 g/mol
LogP0.56
Rot. Bonds5

About [2-(4-ethoxypiperidin-1-yl)sulfonyl-3-pyridinyl]hydrazine

[2-(4-ethoxypiperidin-1-yl)sulfonyl-3-pyridinyl]hydrazine (PubChem CID 103301047) has the molecular formula C12H20N4O3S and a molecular weight of 300.38 g/mol. Its IUPAC name is [2-(4-ethoxypiperidin-1-yl)sulfonyl-3-pyridinyl]hydrazine.

Molecular Properties

Compound Name[2-(4-ethoxypiperidin-1-yl)sulfonyl-3-pyridinyl]hydrazine
PubChem CID103301047
Molecular FormulaC12H20N4O3S
Molecular Weight300.38 g/mol
Exact Mass300.13
IUPAC Name[2-(4-ethoxypiperidin-1-yl)sulfonyl-3-pyridinyl]hydrazine
SMILESCCOC1CCN(S(=O)(=O)c2ncccc2NN)CC1
InChIInChI=1S/C12H20N4O3S/c1-2-19-10-5-8-16(9-6-10)20(17,18)12-11(15-13)4-3-7-14-12/h3-4,7,10,15H,2,5-6,8-9,13H2,1H3
InChIKeyCPHQHMKKRMOQFS-UHFFFAOYSA-N
XLogP0.56
TPSA97.55 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.38
LogP ≤ 50.56
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
[2-[4-(methoxymethyl)piperidin-1-yl]sulfonyl-3-pyridinyl]hydrazine
CID 103301600
[2-(4-cyclopropylpiperazin-1-yl)sulfonyl-3-pyridinyl]hydrazine
CID 103301085
1-[(3-hydrazinyl-2-pyridinyl)sulfonyl]pyrrolidin-3-ol
CID 103301477
[2-(3-methoxy-4-methylpiperidin-1-yl)sulfonyl-3-pyridinyl]hydrazine
CID 103302177
[5-(4-ethoxypiperidin-1-yl)sulfonylpyrimidin-2-yl]hydrazine
CID 61329704
[2-(3,4,5-trimethylpiperazin-1-yl)sulfonyl-3-pyridinyl]hydrazine
CID 103302119
2-(4-methylpiperidin-1-yl)sulfonyl-N-propylpyridin-3-amine
CID 103303589
1-[1-[[3-(methylamino)-2-pyridinyl]sulfonyl]piperidin-4-yl]ethanol
CID 106837532
[2-(3,4,4a,5,6,7,8,8a-octahydro-2H-quinolin-1-ylsulfonyl)-3-pyridinyl]hydrazine
CID 103301021
[5-bromo-3-(4-ethoxypiperidin-1-yl)sulfonyl-2-pyridinyl]hydrazine
CID 61298747
4-(4-ethoxypiperidin-1-yl)sulfonylaniline
CID 61219591

Frequently Asked Questions

What is the IUPAC name of [2-(4-ethoxypiperidin-1-yl)sulfonyl-3-pyridinyl]hydrazine?
The IUPAC name of [2-(4-ethoxypiperidin-1-yl)sulfonyl-3-pyridinyl]hydrazine (CID 103301047) is [2-(4-ethoxypiperidin-1-yl)sulfonyl-3-pyridinyl]hydrazine.
What is the SMILES notation for [2-(4-ethoxypiperidin-1-yl)sulfonyl-3-pyridinyl]hydrazine?
The canonical SMILES for [2-(4-ethoxypiperidin-1-yl)sulfonyl-3-pyridinyl]hydrazine is CCOC1CCN(S(=O)(=O)c2ncccc2NN)CC1.
What is the InChIKey of [2-(4-ethoxypiperidin-1-yl)sulfonyl-3-pyridinyl]hydrazine?
The InChIKey is CPHQHMKKRMOQFS-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N4O3S/c1-2-19-10-5-8-16(9-6-10)20(17,18)12-11(15-13)4-3-7-14-12/h3-4,7,10,15H,2,5-6,8-9,13H2,1H3.
What are the key properties of [2-(4-ethoxypiperidin-1-yl)sulfonyl-3-pyridinyl]hydrazine?
[2-(4-ethoxypiperidin-1-yl)sulfonyl-3-pyridinyl]hydrazine has a molecular weight of 300.38 g/mol, XLogP of 0.56, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(4-ethoxypiperidin-1-yl)sulfonyl-3-pyridinyl]hydrazine is sourced from PubChem (CID 103301047), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).