N-(4-ethoxyphenyl)ethanesulfonohydrazide

C10H16N2O3S — CID 21126675

IUPACN-(4-ethoxyphenyl)ethanesulfonohydrazide
SMILESCCOc1ccc(N(N)S(=O)(=O)CC)cc1
InChIInChI=1S/C10H16N2O3S/c1-3-15-10-7-5-9(6-8-10)12(11)16(13,14)4-2/h5-8H,3-4,11H2,1-2H3
InChIKeyRJVLARWQQHXBJG-UHFFFAOYSA-N
MW244.32 g/mol
LogP1.12
Rot. Bonds5

About N-(4-ethoxyphenyl)ethanesulfonohydrazide

N-(4-ethoxyphenyl)ethanesulfonohydrazide (PubChem CID 21126675) has the molecular formula C10H16N2O3S and a molecular weight of 244.32 g/mol. Its IUPAC name is N-(4-ethoxyphenyl)ethanesulfonohydrazide.

Molecular Properties

Compound NameN-(4-ethoxyphenyl)ethanesulfonohydrazide
PubChem CID21126675
Molecular FormulaC10H16N2O3S
Molecular Weight244.32 g/mol
Exact Mass244.09
IUPAC NameN-(4-ethoxyphenyl)ethanesulfonohydrazide
SMILESCCOc1ccc(N(N)S(=O)(=O)CC)cc1
InChIInChI=1S/C10H16N2O3S/c1-3-15-10-7-5-9(6-8-10)12(11)16(13,14)4-2/h5-8H,3-4,11H2,1-2H3
InChIKeyRJVLARWQQHXBJG-UHFFFAOYSA-N
XLogP1.12
TPSA72.63 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.32
LogP ≤ 51.12
H-Bond Donors ≤ 51
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

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1-ethoxy-4-ethylsulfonylbenzene
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4-ethoxy-N-(4-ethoxyphenyl)-N-phenylaniline
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4-ethoxybenzenesulfonic acid
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ethyl (2S)-2-(N-acetyl-4-ethoxyanilino)propanoate
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N-[2-(4-ethoxy-N-methylsulfonylanilino)ethyl]propane-1-sulfonamide
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N-(4-ethoxyphenyl)-2-(4-methylphenoxy)-N-(4-methylphenyl)sulfonylacetamide
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Frequently Asked Questions

What is the IUPAC name of N-(4-ethoxyphenyl)ethanesulfonohydrazide?
The IUPAC name of N-(4-ethoxyphenyl)ethanesulfonohydrazide (CID 21126675) is N-(4-ethoxyphenyl)ethanesulfonohydrazide.
What is the SMILES notation for N-(4-ethoxyphenyl)ethanesulfonohydrazide?
The canonical SMILES for N-(4-ethoxyphenyl)ethanesulfonohydrazide is CCOc1ccc(N(N)S(=O)(=O)CC)cc1.
What is the InChIKey of N-(4-ethoxyphenyl)ethanesulfonohydrazide?
The InChIKey is RJVLARWQQHXBJG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2O3S/c1-3-15-10-7-5-9(6-8-10)12(11)16(13,14)4-2/h5-8H,3-4,11H2,1-2H3.
What are the key properties of N-(4-ethoxyphenyl)ethanesulfonohydrazide?
N-(4-ethoxyphenyl)ethanesulfonohydrazide has a molecular weight of 244.32 g/mol, XLogP of 1.12, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-ethoxyphenyl)ethanesulfonohydrazide is sourced from PubChem (CID 21126675), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).