[1-(3-methoxythiophen-2-yl)-2-(1-methylsulfonylpiperidin-3-yl)ethyl]hydrazine

C13H23N3O3S2 — CID 105322822

IUPAC[1-(3-methoxythiophen-2-yl)-2-(1-methylsulfonylpiperidin-3-yl)ethyl]hydrazine
SMILESCOc1ccsc1C(CC1CCCN(S(C)(=O)=O)C1)NN
InChIInChI=1S/C13H23N3O3S2/c1-19-12-5-7-20-13(12)11(15-14)8-10-4-3-6-16(9-10)21(2,17)18/h5,7,10-11,15H,3-4,6,8-9,14H2,1-2H3
InChIKeyIWMMCTBFHRLLJS-UHFFFAOYSA-N
MW333.48 g/mol
LogP1.32
Rot. Bonds6

About [1-(3-methoxythiophen-2-yl)-2-(1-methylsulfonylpiperidin-3-yl)ethyl]hydrazine

[1-(3-methoxythiophen-2-yl)-2-(1-methylsulfonylpiperidin-3-yl)ethyl]hydrazine (PubChem CID 105322822) has the molecular formula C13H23N3O3S2 and a molecular weight of 333.48 g/mol. Its IUPAC name is [1-(3-methoxythiophen-2-yl)-2-(1-methylsulfonylpiperidin-3-yl)ethyl]hydrazine.

Molecular Properties

Compound Name[1-(3-methoxythiophen-2-yl)-2-(1-methylsulfonylpiperidin-3-yl)ethyl]hydrazine
PubChem CID105322822
Molecular FormulaC13H23N3O3S2
Molecular Weight333.48 g/mol
Exact Mass333.12
IUPAC Name[1-(3-methoxythiophen-2-yl)-2-(1-methylsulfonylpiperidin-3-yl)ethyl]hydrazine
SMILESCOc1ccsc1C(CC1CCCN(S(C)(=O)=O)C1)NN
InChIInChI=1S/C13H23N3O3S2/c1-19-12-5-7-20-13(12)11(15-14)8-10-4-3-6-16(9-10)21(2,17)18/h5,7,10-11,15H,3-4,6,8-9,14H2,1-2H3
InChIKeyIWMMCTBFHRLLJS-UHFFFAOYSA-N
XLogP1.32
TPSA84.66 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500333.48
LogP ≤ 51.32
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-[1-hydrazinyl-2-(1-methylsulfonylpiperidin-3-yl)ethyl]aniline
CID 105223840
[1-(1-methylpyrazol-3-yl)-2-(1-methylsulfonylpiperidin-3-yl)ethyl]hydrazine
CID 105228709
[1-(2-chlorofuran-3-yl)-2-(1-methylsulfonylpiperidin-3-yl)ethyl]hydrazine
CID 106694587
2-(1-methylsulfonylpiperidin-3-yl)-1-thiophen-2-ylethanol
CID 79612108
[1-(3-fluoro-2-pyridinyl)-2-(1-methylsulfonylpiperidin-3-yl)ethyl]hydrazine
CID 105257833
1-(3-methoxythiophen-2-yl)propylhydrazine
CID 105281967
[1-(1,5-dimethylpyrazol-4-yl)-2-(1-methylsulfonylpiperidin-3-yl)ethyl]hydrazine
CID 105322786
1-[(3R)-1-(3-methoxythiophen-2-yl)sulfonylpiperidin-3-yl]-N-methylmethanamine
CID 124688256
[1-(5-fluoro-3-pyridinyl)-2-(1-methylsulfonylpiperidin-3-yl)ethyl]hydrazine
CID 105322812
N-methyl-1-(1-methylsulfonylpiperidin-3-yl)-3-thiophen-2-ylpropan-2-amine
CID 79611861
4-fluoro-3-methoxy-N-[(1-methylsulfonylpiperidin-3-yl)methyl]aniline
CID 114839567
2-(1-methylsulfonylpiperidin-3-yl)-1-phenylethanamine
CID 79610284

Frequently Asked Questions

What is the IUPAC name of [1-(3-methoxythiophen-2-yl)-2-(1-methylsulfonylpiperidin-3-yl)ethyl]hydrazine?
The IUPAC name of [1-(3-methoxythiophen-2-yl)-2-(1-methylsulfonylpiperidin-3-yl)ethyl]hydrazine (CID 105322822) is [1-(3-methoxythiophen-2-yl)-2-(1-methylsulfonylpiperidin-3-yl)ethyl]hydrazine.
What is the SMILES notation for [1-(3-methoxythiophen-2-yl)-2-(1-methylsulfonylpiperidin-3-yl)ethyl]hydrazine?
The canonical SMILES for [1-(3-methoxythiophen-2-yl)-2-(1-methylsulfonylpiperidin-3-yl)ethyl]hydrazine is COc1ccsc1C(CC1CCCN(S(C)(=O)=O)C1)NN.
What is the InChIKey of [1-(3-methoxythiophen-2-yl)-2-(1-methylsulfonylpiperidin-3-yl)ethyl]hydrazine?
The InChIKey is IWMMCTBFHRLLJS-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23N3O3S2/c1-19-12-5-7-20-13(12)11(15-14)8-10-4-3-6-16(9-10)21(2,17)18/h5,7,10-11,15H,3-4,6,8-9,14H2,1-2H3.
What are the key properties of [1-(3-methoxythiophen-2-yl)-2-(1-methylsulfonylpiperidin-3-yl)ethyl]hydrazine?
[1-(3-methoxythiophen-2-yl)-2-(1-methylsulfonylpiperidin-3-yl)ethyl]hydrazine has a molecular weight of 333.48 g/mol, XLogP of 1.32, 6 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(3-methoxythiophen-2-yl)-2-(1-methylsulfonylpiperidin-3-yl)ethyl]hydrazine is sourced from PubChem (CID 105322822), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).