[4-ethylsulfonyl-1-(1-methoxycyclopentyl)butyl]hydrazine

C12H26N2O3S — CID 105268624

IUPAC[4-ethylsulfonyl-1-(1-methoxycyclopentyl)butyl]hydrazine
SMILESCCS(=O)(=O)CCCC(NN)C1(OC)CCCC1
InChIInChI=1S/C12H26N2O3S/c1-3-18(15,16)10-6-7-11(14-13)12(17-2)8-4-5-9-12/h11,14H,3-10,13H2,1-2H3
InChIKeyAHDCPSJBHRDJID-UHFFFAOYSA-N
MW278.42 g/mol
LogP0.99
Rot. Bonds8

About [4-ethylsulfonyl-1-(1-methoxycyclopentyl)butyl]hydrazine

[4-ethylsulfonyl-1-(1-methoxycyclopentyl)butyl]hydrazine (PubChem CID 105268624) has the molecular formula C12H26N2O3S and a molecular weight of 278.42 g/mol. Its IUPAC name is [4-ethylsulfonyl-1-(1-methoxycyclopentyl)butyl]hydrazine.

Molecular Properties

Compound Name[4-ethylsulfonyl-1-(1-methoxycyclopentyl)butyl]hydrazine
PubChem CID105268624
Molecular FormulaC12H26N2O3S
Molecular Weight278.42 g/mol
Exact Mass278.17
IUPAC Name[4-ethylsulfonyl-1-(1-methoxycyclopentyl)butyl]hydrazine
SMILESCCS(=O)(=O)CCCC(NN)C1(OC)CCCC1
InChIInChI=1S/C12H26N2O3S/c1-3-18(15,16)10-6-7-11(14-13)12(17-2)8-4-5-9-12/h11,14H,3-10,13H2,1-2H3
InChIKeyAHDCPSJBHRDJID-UHFFFAOYSA-N
XLogP0.99
TPSA81.42 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.42
LogP ≤ 50.99
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-(1-ethoxycyclopentyl)-4-ethylsulfonylbutyl]hydrazine
CID 105275655
4-ethylsulfonyl-1-(1-methoxycyclohexyl)-N-methylbutan-1-amine
CID 116762936
1-(1-methoxycyclohexyl)hexylhydrazine
CID 105276130
[1-(1-ethylcyclopentyl)-4-ethylsulfonylbutyl]hydrazine
CID 105310891
1-(1-methoxycycloheptyl)heptylhydrazine
CID 105278282
1-(1-methoxycycloheptyl)butylhydrazine
CID 105278151
1-(1-methoxycyclobutyl)heptylhydrazine
CID 105270416
[1-(1-methoxy-4-methylcyclohexyl)-4-methylsulfonylbutyl]hydrazine
CID 105277043
[1-(1-ethoxy-4-methylcyclohexyl)-4-ethylsulfonylbutyl]hydrazine
CID 105277264
1-(1-ethoxycyclopentyl)-4-ethylsulfonyl-N-methylbutan-1-amine
CID 116761963
N-ethyl-4-ethylsulfonyl-1-(4-methoxyoxan-4-yl)butan-1-amine
CID 116764968
1-(1-methoxycyclopentyl)oct-7-enylhydrazine
CID 107012644

Frequently Asked Questions

What is the IUPAC name of [4-ethylsulfonyl-1-(1-methoxycyclopentyl)butyl]hydrazine?
The IUPAC name of [4-ethylsulfonyl-1-(1-methoxycyclopentyl)butyl]hydrazine (CID 105268624) is [4-ethylsulfonyl-1-(1-methoxycyclopentyl)butyl]hydrazine.
What is the SMILES notation for [4-ethylsulfonyl-1-(1-methoxycyclopentyl)butyl]hydrazine?
The canonical SMILES for [4-ethylsulfonyl-1-(1-methoxycyclopentyl)butyl]hydrazine is CCS(=O)(=O)CCCC(NN)C1(OC)CCCC1.
What is the InChIKey of [4-ethylsulfonyl-1-(1-methoxycyclopentyl)butyl]hydrazine?
The InChIKey is AHDCPSJBHRDJID-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H26N2O3S/c1-3-18(15,16)10-6-7-11(14-13)12(17-2)8-4-5-9-12/h11,14H,3-10,13H2,1-2H3.
What are the key properties of [4-ethylsulfonyl-1-(1-methoxycyclopentyl)butyl]hydrazine?
[4-ethylsulfonyl-1-(1-methoxycyclopentyl)butyl]hydrazine has a molecular weight of 278.42 g/mol, XLogP of 0.99, 8 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [4-ethylsulfonyl-1-(1-methoxycyclopentyl)butyl]hydrazine is sourced from PubChem (CID 105268624), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).