(1-ethylsulfonyl-5,6-dimethylheptan-4-yl)hydrazine

C11H26N2O2S — CID 105310922

IUPAC(1-ethylsulfonyl-5,6-dimethylheptan-4-yl)hydrazine
SMILESCCS(=O)(=O)CCCC(NN)C(C)C(C)C
InChIInChI=1S/C11H26N2O2S/c1-5-16(14,15)8-6-7-11(13-12)10(4)9(2)3/h9-11,13H,5-8,12H2,1-4H3
InChIKeyJBGSNALCMTVLMB-UHFFFAOYSA-N
MW250.41 g/mol
LogP1.33
Rot. Bonds8

About (1-ethylsulfonyl-5,6-dimethylheptan-4-yl)hydrazine

(1-ethylsulfonyl-5,6-dimethylheptan-4-yl)hydrazine (PubChem CID 105310922) has the molecular formula C11H26N2O2S and a molecular weight of 250.41 g/mol. Its IUPAC name is (1-ethylsulfonyl-5,6-dimethylheptan-4-yl)hydrazine.

Molecular Properties

Compound Name(1-ethylsulfonyl-5,6-dimethylheptan-4-yl)hydrazine
PubChem CID105310922
Molecular FormulaC11H26N2O2S
Molecular Weight250.41 g/mol
Exact Mass250.17
IUPAC Name(1-ethylsulfonyl-5,6-dimethylheptan-4-yl)hydrazine
SMILESCCS(=O)(=O)CCCC(NN)C(C)C(C)C
InChIInChI=1S/C11H26N2O2S/c1-5-16(14,15)8-6-7-11(13-12)10(4)9(2)3/h9-11,13H,5-8,12H2,1-4H3
InChIKeyJBGSNALCMTVLMB-UHFFFAOYSA-N
XLogP1.33
TPSA72.19 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.41
LogP ≤ 51.33
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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

[6-Ethylsulfonyl-1,1,1-trifluoro-2-(trifluoromethyl)hexan-3-yl]hydrazine
CID 103312818
[4-Ethylsulfonyl-1-[2-(trifluoromethyl)cyclohexyl]butyl]hydrazine
CID 105310967
(1-Cyclobutyl-5-methylsulfonylpentan-2-yl)hydrazine
CID 103170426
(1-Cyclobutyl-5-ethylsulfonylpentan-2-yl)hydrazine
CID 103170569
[2-Cyclobutyl-1-(3-methylsulfonylcyclohexyl)ethyl]hydrazine
CID 103170683
1-Ethylsulfonyl-5,6-dimethylheptan-4-amine
CID 104986203
(1-Ethylsulfonyl-6-methylheptan-4-yl)hydrazine
CID 105198871
(6-Methyl-1-methylsulfonylheptan-4-yl)hydrazine
CID 105198878
[3-Methyl-1-(3-methylsulfonylcyclohexyl)butyl]hydrazine
CID 105199009
(6-Ethylsulfonyl-2-methylhexan-3-yl)hydrazine
CID 105199486
(2-Methyl-6-methylsulfonylhexan-3-yl)hydrazine
CID 105199494
[2-Methyl-1-(3-methylsulfonylcyclohexyl)propyl]hydrazine
CID 105199611

Frequently Asked Questions

What is the IUPAC name of (1-ethylsulfonyl-5,6-dimethylheptan-4-yl)hydrazine?
The IUPAC name of (1-ethylsulfonyl-5,6-dimethylheptan-4-yl)hydrazine (CID 105310922) is (1-ethylsulfonyl-5,6-dimethylheptan-4-yl)hydrazine.
What is the SMILES notation for (1-ethylsulfonyl-5,6-dimethylheptan-4-yl)hydrazine?
The canonical SMILES for (1-ethylsulfonyl-5,6-dimethylheptan-4-yl)hydrazine is CCS(=O)(=O)CCCC(NN)C(C)C(C)C.
What is the InChIKey of (1-ethylsulfonyl-5,6-dimethylheptan-4-yl)hydrazine?
The InChIKey is JBGSNALCMTVLMB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H26N2O2S/c1-5-16(14,15)8-6-7-11(13-12)10(4)9(2)3/h9-11,13H,5-8,12H2,1-4H3.
What are the key properties of (1-ethylsulfonyl-5,6-dimethylheptan-4-yl)hydrazine?
(1-ethylsulfonyl-5,6-dimethylheptan-4-yl)hydrazine has a molecular weight of 250.41 g/mol, XLogP of 1.33, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (1-ethylsulfonyl-5,6-dimethylheptan-4-yl)hydrazine is sourced from PubChem (CID 105310922), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).