(2-methyl-2-methylsulfonyl-1-thiophen-3-ylpropyl)hydrazine

C9H16N2O2S2 — CID 105312096

IUPAC(2-methyl-2-methylsulfonyl-1-thiophen-3-ylpropyl)hydrazine
SMILESCC(C)(C(NN)c1ccsc1)S(C)(=O)=O
InChIInChI=1S/C9H16N2O2S2/c1-9(2,15(3,12)13)8(11-10)7-4-5-14-6-7/h4-6,8,11H,10H2,1-3H3
InChIKeyWCWKWWZGIQTYSW-UHFFFAOYSA-N
MW248.37 g/mol
LogP1.08
Rot. Bonds4

About (2-methyl-2-methylsulfonyl-1-thiophen-3-ylpropyl)hydrazine

(2-methyl-2-methylsulfonyl-1-thiophen-3-ylpropyl)hydrazine (PubChem CID 105312096) has the molecular formula C9H16N2O2S2 and a molecular weight of 248.37 g/mol. Its IUPAC name is (2-methyl-2-methylsulfonyl-1-thiophen-3-ylpropyl)hydrazine.

Molecular Properties

Compound Name(2-methyl-2-methylsulfonyl-1-thiophen-3-ylpropyl)hydrazine
PubChem CID105312096
Molecular FormulaC9H16N2O2S2
Molecular Weight248.37 g/mol
Exact Mass248.07
IUPAC Name(2-methyl-2-methylsulfonyl-1-thiophen-3-ylpropyl)hydrazine
SMILESCC(C)(C(NN)c1ccsc1)S(C)(=O)=O
InChIInChI=1S/C9H16N2O2S2/c1-9(2,15(3,12)13)8(11-10)7-4-5-14-6-7/h4-6,8,11H,10H2,1-3H3
InChIKeyWCWKWWZGIQTYSW-UHFFFAOYSA-N
XLogP1.08
TPSA72.19 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.37
LogP ≤ 51.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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-methyl-2-methylsulfonyl-1-(4-propan-2-ylphenyl)propyl]hydrazine
CID 105304336
(2-methyl-2-piperidin-1-yl-1-thiophen-3-ylpropyl)hydrazine
CID 105239795
[2-methyl-2-methylsulfonyl-1-(4-propylphenyl)propyl]hydrazine
CID 105303910
1-hydrazinyl-N,N,2-trimethyl-1-thiophen-3-ylbutan-2-amine
CID 105240466
(3-methylsulfonyl-1-thiophen-3-ylpropyl)hydrazine
CID 114984529
N,2,2-trimethyl-1-thiophen-3-ylpropan-1-amine
CID 62395733
[1-[4-fluoro-3-(trifluoromethyl)phenyl]-2-methyl-2-methylsulfonylpropyl]hydrazine
CID 107292604
[2-[(2-methylpropan-2-yl)oxy]-1-thiophen-3-ylethyl]hydrazine
CID 105312095
[1-(3-fluoro-4-pyridinyl)-2-methyl-2-methylsulfonylpropyl]hydrazine
CID 105335480
[(4-tert-butylcyclohexyl)-thiophen-3-ylmethyl]hydrazine
CID 105232646
N-methyl-1-thiophen-3-ylethanesulfonamide
CID 165445460
N-ethyl-2-methyl-2-piperidin-1-yl-1-thiophen-3-ylpropan-1-amine
CID 79045109

Frequently Asked Questions

What is the IUPAC name of (2-methyl-2-methylsulfonyl-1-thiophen-3-ylpropyl)hydrazine?
The IUPAC name of (2-methyl-2-methylsulfonyl-1-thiophen-3-ylpropyl)hydrazine (CID 105312096) is (2-methyl-2-methylsulfonyl-1-thiophen-3-ylpropyl)hydrazine.
What is the SMILES notation for (2-methyl-2-methylsulfonyl-1-thiophen-3-ylpropyl)hydrazine?
The canonical SMILES for (2-methyl-2-methylsulfonyl-1-thiophen-3-ylpropyl)hydrazine is CC(C)(C(NN)c1ccsc1)S(C)(=O)=O.
What is the InChIKey of (2-methyl-2-methylsulfonyl-1-thiophen-3-ylpropyl)hydrazine?
The InChIKey is WCWKWWZGIQTYSW-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16N2O2S2/c1-9(2,15(3,12)13)8(11-10)7-4-5-14-6-7/h4-6,8,11H,10H2,1-3H3.
What are the key properties of (2-methyl-2-methylsulfonyl-1-thiophen-3-ylpropyl)hydrazine?
(2-methyl-2-methylsulfonyl-1-thiophen-3-ylpropyl)hydrazine has a molecular weight of 248.37 g/mol, XLogP of 1.08, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (2-methyl-2-methylsulfonyl-1-thiophen-3-ylpropyl)hydrazine is sourced from PubChem (CID 105312096), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).