(2-ethoxy-6-methylsulfonylhexan-3-yl)hydrazine

C9H22N2O3S — CID 105222762

IUPAC(2-ethoxy-6-methylsulfonylhexan-3-yl)hydrazine
SMILESCCOC(C)C(CCCS(C)(=O)=O)NN
InChIInChI=1S/C9H22N2O3S/c1-4-14-8(2)9(11-10)6-5-7-15(3,12)13/h8-9,11H,4-7,10H2,1-3H3
InChIKeyCGGIYMRGTDIHID-UHFFFAOYSA-N
MW238.35 g/mol
LogP0.07
Rot. Bonds8

About (2-ethoxy-6-methylsulfonylhexan-3-yl)hydrazine

(2-ethoxy-6-methylsulfonylhexan-3-yl)hydrazine (PubChem CID 105222762) has the molecular formula C9H22N2O3S and a molecular weight of 238.35 g/mol. Its IUPAC name is (2-ethoxy-6-methylsulfonylhexan-3-yl)hydrazine.

Molecular Properties

Compound Name(2-ethoxy-6-methylsulfonylhexan-3-yl)hydrazine
PubChem CID105222762
Molecular FormulaC9H22N2O3S
Molecular Weight238.35 g/mol
Exact Mass238.14
IUPAC Name(2-ethoxy-6-methylsulfonylhexan-3-yl)hydrazine
SMILESCCOC(C)C(CCCS(C)(=O)=O)NN
InChIInChI=1S/C9H22N2O3S/c1-4-14-8(2)9(11-10)6-5-7-15(3,12)13/h8-9,11H,4-7,10H2,1-3H3
InChIKeyCGGIYMRGTDIHID-UHFFFAOYSA-N
XLogP0.07
TPSA81.42 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.35
LogP ≤ 50.07
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

[5-Methylsulfonyl-1-(2,2,2-trifluoroethoxy)pentan-2-yl]hydrazine
CID 103217325
[5-Ethylsulfonyl-1-(2,2,2-trifluoroethoxy)pentan-2-yl]hydrazine
CID 103217527
[5-Methylsulfonyl-1-(2,2,3,3-tetrafluoropropoxy)pentan-2-yl]hydrazine
CID 103477523
[5-Ethylsulfonyl-1-(2,2,3,3-tetrafluoropropoxy)pentan-2-yl]hydrazine
CID 103477812
2-Ethoxy-6-methylsulfonylhexan-3-amine
CID 64540280
2-Ethoxy-6-ethylsulfonylhexan-3-amine
CID 65095664
6-Ethylsulfonyl-2-methoxyhexan-3-amine
CID 79616074
2-Methoxy-6-methylsulfonylhexan-3-amine
CID 79617509
[1-(2-Methoxyethoxy)-6-methylsulfonylhexan-3-yl]hydrazine
CID 102929756
5-Methylsulfonyl-1-propan-2-yloxypentan-2-amine
CID 105112986
5-Ethylsulfonyl-1-propan-2-yloxypentan-2-amine
CID 105152550
[5-Methylsulfonyl-1-(oxolan-2-yl)pentan-2-yl]hydrazine
CID 105198538

Frequently Asked Questions

What is the IUPAC name of (2-ethoxy-6-methylsulfonylhexan-3-yl)hydrazine?
The IUPAC name of (2-ethoxy-6-methylsulfonylhexan-3-yl)hydrazine (CID 105222762) is (2-ethoxy-6-methylsulfonylhexan-3-yl)hydrazine.
What is the SMILES notation for (2-ethoxy-6-methylsulfonylhexan-3-yl)hydrazine?
The canonical SMILES for (2-ethoxy-6-methylsulfonylhexan-3-yl)hydrazine is CCOC(C)C(CCCS(C)(=O)=O)NN.
What is the InChIKey of (2-ethoxy-6-methylsulfonylhexan-3-yl)hydrazine?
The InChIKey is CGGIYMRGTDIHID-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H22N2O3S/c1-4-14-8(2)9(11-10)6-5-7-15(3,12)13/h8-9,11H,4-7,10H2,1-3H3.
What are the key properties of (2-ethoxy-6-methylsulfonylhexan-3-yl)hydrazine?
(2-ethoxy-6-methylsulfonylhexan-3-yl)hydrazine has a molecular weight of 238.35 g/mol, XLogP of 0.07, 8 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (2-ethoxy-6-methylsulfonylhexan-3-yl)hydrazine is sourced from PubChem (CID 105222762), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).