(1-ethylsulfonyl-6-methoxy-6-methylheptan-4-yl)hydrazine

C11H26N2O3S — CID 103025337

IUPAC(1-ethylsulfonyl-6-methoxy-6-methylheptan-4-yl)hydrazine
SMILESCCS(=O)(=O)CCCC(CC(C)(C)OC)NN
InChIInChI=1S/C11H26N2O3S/c1-5-17(14,15)8-6-7-10(13-12)9-11(2,3)16-4/h10,13H,5-9,12H2,1-4H3
InChIKeyFYBJAEYSIVEUIF-UHFFFAOYSA-N
MW266.41 g/mol
LogP0.85
Rot. Bonds9

About (1-ethylsulfonyl-6-methoxy-6-methylheptan-4-yl)hydrazine

(1-ethylsulfonyl-6-methoxy-6-methylheptan-4-yl)hydrazine (PubChem CID 103025337) has the molecular formula C11H26N2O3S and a molecular weight of 266.41 g/mol. Its IUPAC name is (1-ethylsulfonyl-6-methoxy-6-methylheptan-4-yl)hydrazine.

Molecular Properties

Compound Name(1-ethylsulfonyl-6-methoxy-6-methylheptan-4-yl)hydrazine
PubChem CID103025337
Molecular FormulaC11H26N2O3S
Molecular Weight266.41 g/mol
Exact Mass266.17
IUPAC Name(1-ethylsulfonyl-6-methoxy-6-methylheptan-4-yl)hydrazine
SMILESCCS(=O)(=O)CCCC(CC(C)(C)OC)NN
InChIInChI=1S/C11H26N2O3S/c1-5-17(14,15)8-6-7-10(13-12)9-11(2,3)16-4/h10,13H,5-9,12H2,1-4H3
InChIKeyFYBJAEYSIVEUIF-UHFFFAOYSA-N
XLogP0.85
TPSA81.42 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds9
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.41
LogP ≤ 50.85
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

1-ethylsulfonyl-6-methoxy-6-methyl-N-propylheptan-4-amine
CID 103027266
(2-methoxy-2-methyloctan-4-yl)hydrazine
CID 103025232
[5-ethylsulfonyl-1-[(2-methylpropan-2-yl)oxy]pentan-2-yl]hydrazine
CID 105310977
[5-ethylsulfonyl-1-(1-methoxycyclobutyl)pentan-2-yl]hydrazine
CID 103560469
[6-ethylsulfonyl-1-(4-methoxyphenyl)hexan-3-yl]hydrazine
CID 105310787
(2-ethoxy-6-ethylsulfonyl-2-methylhexan-3-yl)hydrazine
CID 105273996
1-ethylsulfonyl-5-methoxy-5-methylheptan-4-ol
CID 116752031
N-ethyl-1-ethylsulfonyl-5-methoxy-5-methylheptan-4-amine
CID 116757969
(5-ethoxy-1-ethylsulfonyl-6,6-dimethylheptan-4-yl)hydrazine
CID 105273689
1-ethylsulfonyl-5-methoxy-6,6-dimethyl-N-propylheptan-4-amine
CID 116725019
5-ethyl-1-ethylsulfonyl-5-methoxy-N-methylheptan-4-amine
CID 116760878
6-(3-methoxypropylsulfonyl)-N-methylhexan-3-amine
CID 106807839

Frequently Asked Questions

What is the IUPAC name of (1-ethylsulfonyl-6-methoxy-6-methylheptan-4-yl)hydrazine?
The IUPAC name of (1-ethylsulfonyl-6-methoxy-6-methylheptan-4-yl)hydrazine (CID 103025337) is (1-ethylsulfonyl-6-methoxy-6-methylheptan-4-yl)hydrazine.
What is the SMILES notation for (1-ethylsulfonyl-6-methoxy-6-methylheptan-4-yl)hydrazine?
The canonical SMILES for (1-ethylsulfonyl-6-methoxy-6-methylheptan-4-yl)hydrazine is CCS(=O)(=O)CCCC(CC(C)(C)OC)NN.
What is the InChIKey of (1-ethylsulfonyl-6-methoxy-6-methylheptan-4-yl)hydrazine?
The InChIKey is FYBJAEYSIVEUIF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H26N2O3S/c1-5-17(14,15)8-6-7-10(13-12)9-11(2,3)16-4/h10,13H,5-9,12H2,1-4H3.
What are the key properties of (1-ethylsulfonyl-6-methoxy-6-methylheptan-4-yl)hydrazine?
(1-ethylsulfonyl-6-methoxy-6-methylheptan-4-yl)hydrazine has a molecular weight of 266.41 g/mol, XLogP of 0.85, 9 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (1-ethylsulfonyl-6-methoxy-6-methylheptan-4-yl)hydrazine is sourced from PubChem (CID 103025337), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).