(1-cyclopropyl-1-ethoxy-5-ethylsulfonylpentan-2-yl)hydrazine

C12H26N2O3S — CID 105273025

IUPAC(1-cyclopropyl-1-ethoxy-5-ethylsulfonylpentan-2-yl)hydrazine
SMILESCCOC(C1CC1)C(CCCS(=O)(=O)CC)NN
InChIInChI=1S/C12H26N2O3S/c1-3-17-12(10-7-8-10)11(14-13)6-5-9-18(15,16)4-2/h10-12,14H,3-9,13H2,1-2H3
InChIKeyLCLFCTRBDVIQES-UHFFFAOYSA-N
MW278.42 g/mol
LogP0.85
Rot. Bonds10

About (1-cyclopropyl-1-ethoxy-5-ethylsulfonylpentan-2-yl)hydrazine

(1-cyclopropyl-1-ethoxy-5-ethylsulfonylpentan-2-yl)hydrazine (PubChem CID 105273025) has the molecular formula C12H26N2O3S and a molecular weight of 278.42 g/mol. Its IUPAC name is (1-cyclopropyl-1-ethoxy-5-ethylsulfonylpentan-2-yl)hydrazine.

Molecular Properties

Compound Name(1-cyclopropyl-1-ethoxy-5-ethylsulfonylpentan-2-yl)hydrazine
PubChem CID105273025
Molecular FormulaC12H26N2O3S
Molecular Weight278.42 g/mol
Exact Mass278.17
IUPAC Name(1-cyclopropyl-1-ethoxy-5-ethylsulfonylpentan-2-yl)hydrazine
SMILESCCOC(C1CC1)C(CCCS(=O)(=O)CC)NN
InChIInChI=1S/C12H26N2O3S/c1-3-17-12(10-7-8-10)11(14-13)6-5-9-18(15,16)4-2/h10-12,14H,3-9,13H2,1-2H3
InChIKeyLCLFCTRBDVIQES-UHFFFAOYSA-N
XLogP0.85
TPSA81.42 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds10
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.42
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

(5-ethoxy-1-ethylsulfonyl-6-methylheptan-4-yl)hydrazine
CID 105272341
(1-cyclohexyl-1-ethoxynonan-2-yl)hydrazine
CID 105278827
(5-ethoxy-1-ethylsulfonyl-6,6-dimethylheptan-4-yl)hydrazine
CID 105273689
(1-cyclohexyl-1-ethoxy-5-methoxypentan-2-yl)hydrazine
CID 105278914
[1-cyclopropyl-1-ethoxy-5-(oxolan-2-yl)pentan-2-yl]hydrazine
CID 105273156
(1-cyclohexyl-3-cyclopentyl-1-ethoxypropan-2-yl)hydrazine
CID 105278814
(1-ethylsulfonyl-5,6-dimethylheptan-4-yl)hydrazine
CID 105310922
1-cyclopropyl-1-ethoxy-N-methylbutan-2-amine
CID 116723276
(1-cyclopropyl-1-ethoxy-4-thiophen-2-ylbutan-2-yl)hydrazine
CID 105273036
[1-cyclopropyl-3-(3,5-difluorophenyl)-1-ethoxypropan-2-yl]hydrazine
CID 105413016
1-cyclopropyl-1,3-diethoxy-N-methylpropan-2-amine
CID 116723302
(2-ethoxy-6-ethylsulfonyl-2-methylhexan-3-yl)hydrazine
CID 105273996

Frequently Asked Questions

What is the IUPAC name of (1-cyclopropyl-1-ethoxy-5-ethylsulfonylpentan-2-yl)hydrazine?
The IUPAC name of (1-cyclopropyl-1-ethoxy-5-ethylsulfonylpentan-2-yl)hydrazine (CID 105273025) is (1-cyclopropyl-1-ethoxy-5-ethylsulfonylpentan-2-yl)hydrazine.
What is the SMILES notation for (1-cyclopropyl-1-ethoxy-5-ethylsulfonylpentan-2-yl)hydrazine?
The canonical SMILES for (1-cyclopropyl-1-ethoxy-5-ethylsulfonylpentan-2-yl)hydrazine is CCOC(C1CC1)C(CCCS(=O)(=O)CC)NN.
What is the InChIKey of (1-cyclopropyl-1-ethoxy-5-ethylsulfonylpentan-2-yl)hydrazine?
The InChIKey is LCLFCTRBDVIQES-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H26N2O3S/c1-3-17-12(10-7-8-10)11(14-13)6-5-9-18(15,16)4-2/h10-12,14H,3-9,13H2,1-2H3.
What are the key properties of (1-cyclopropyl-1-ethoxy-5-ethylsulfonylpentan-2-yl)hydrazine?
(1-cyclopropyl-1-ethoxy-5-ethylsulfonylpentan-2-yl)hydrazine has a molecular weight of 278.42 g/mol, XLogP of 0.85, 10 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (1-cyclopropyl-1-ethoxy-5-ethylsulfonylpentan-2-yl)hydrazine is sourced from PubChem (CID 105273025), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).