[5-ethylsulfonyl-1-(1-methoxycyclobutyl)pentan-2-yl]hydrazine

C12H26N2O3S — CID 103560469

IUPAC[5-ethylsulfonyl-1-(1-methoxycyclobutyl)pentan-2-yl]hydrazine
SMILESCCS(=O)(=O)CCCC(CC1(OC)CCC1)NN
InChIInChI=1S/C12H26N2O3S/c1-3-18(15,16)9-4-6-11(14-13)10-12(17-2)7-5-8-12/h11,14H,3-10,13H2,1-2H3
InChIKeyJFPFXHVLIFKIHY-UHFFFAOYSA-N
MW278.42 g/mol
LogP0.99
Rot. Bonds9

About [5-ethylsulfonyl-1-(1-methoxycyclobutyl)pentan-2-yl]hydrazine

[5-ethylsulfonyl-1-(1-methoxycyclobutyl)pentan-2-yl]hydrazine (PubChem CID 103560469) has the molecular formula C12H26N2O3S and a molecular weight of 278.42 g/mol. Its IUPAC name is [5-ethylsulfonyl-1-(1-methoxycyclobutyl)pentan-2-yl]hydrazine.

Molecular Properties

Compound Name[5-ethylsulfonyl-1-(1-methoxycyclobutyl)pentan-2-yl]hydrazine
PubChem CID103560469
Molecular FormulaC12H26N2O3S
Molecular Weight278.42 g/mol
Exact Mass278.17
IUPAC Name[5-ethylsulfonyl-1-(1-methoxycyclobutyl)pentan-2-yl]hydrazine
SMILESCCS(=O)(=O)CCCC(CC1(OC)CCC1)NN
InChIInChI=1S/C12H26N2O3S/c1-3-18(15,16)9-4-6-11(14-13)10-12(17-2)7-5-8-12/h11,14H,3-10,13H2,1-2H3
InChIKeyJFPFXHVLIFKIHY-UHFFFAOYSA-N
XLogP0.99
TPSA81.42 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds9
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-ethylsulfonyl-6-methoxy-6-methylheptan-4-yl)hydrazine
CID 103025337
[4-ethyl-1-(1-methoxycyclobutyl)hexan-2-yl]hydrazine
CID 103560573
[4-ethylsulfonyl-1-(1-methoxycyclopentyl)butyl]hydrazine
CID 105268624
[1-(1-methoxycyclobutyl)-3-(1-methylsulfonylpiperidin-3-yl)propan-2-yl]hydrazine
CID 103560527
[1-(1-ethoxycyclopentyl)-4-ethylsulfonylbutyl]hydrazine
CID 105275655
[5-ethylsulfonyl-1-[(2-methylpropan-2-yl)oxy]pentan-2-yl]hydrazine
CID 105310977
[1-(1-methoxycyclobutyl)-3-methylhexan-2-yl]hydrazine
CID 107896000
[1-(1-ethylcyclopentyl)-4-ethylsulfonylbutyl]hydrazine
CID 105310891
[6-ethylsulfonyl-1-(4-methoxyphenyl)hexan-3-yl]hydrazine
CID 105310787
4-ethylsulfonyl-1-(1-methoxycyclohexyl)-N-methylbutan-1-amine
CID 116762936
[1-(3-bromo-5-fluorophenyl)-3-(1-methoxycyclobutyl)propan-2-yl]hydrazine
CID 103560538
[1-(1-ethoxy-4-methylcyclohexyl)-4-ethylsulfonylbutyl]hydrazine
CID 105277264

Frequently Asked Questions

What is the IUPAC name of [5-ethylsulfonyl-1-(1-methoxycyclobutyl)pentan-2-yl]hydrazine?
The IUPAC name of [5-ethylsulfonyl-1-(1-methoxycyclobutyl)pentan-2-yl]hydrazine (CID 103560469) is [5-ethylsulfonyl-1-(1-methoxycyclobutyl)pentan-2-yl]hydrazine.
What is the SMILES notation for [5-ethylsulfonyl-1-(1-methoxycyclobutyl)pentan-2-yl]hydrazine?
The canonical SMILES for [5-ethylsulfonyl-1-(1-methoxycyclobutyl)pentan-2-yl]hydrazine is CCS(=O)(=O)CCCC(CC1(OC)CCC1)NN.
What is the InChIKey of [5-ethylsulfonyl-1-(1-methoxycyclobutyl)pentan-2-yl]hydrazine?
The InChIKey is JFPFXHVLIFKIHY-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H26N2O3S/c1-3-18(15,16)9-4-6-11(14-13)10-12(17-2)7-5-8-12/h11,14H,3-10,13H2,1-2H3.
What are the key properties of [5-ethylsulfonyl-1-(1-methoxycyclobutyl)pentan-2-yl]hydrazine?
[5-ethylsulfonyl-1-(1-methoxycyclobutyl)pentan-2-yl]hydrazine has a molecular weight of 278.42 g/mol, XLogP of 0.99, 9 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [5-ethylsulfonyl-1-(1-methoxycyclobutyl)pentan-2-yl]hydrazine is sourced from PubChem (CID 103560469), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).