N'-[4-(2-methoxyphenyl)phenyl]methanesulfonohydrazide

C14H16N2O3S — CID 176904853

IUPACN'-[4-(2-methoxyphenyl)phenyl]methanesulfonohydrazide
SMILESCOc1ccccc1-c1ccc(NNS(C)(=O)=O)cc1
InChIInChI=1S/C14H16N2O3S/c1-19-14-6-4-3-5-13(14)11-7-9-12(10-8-11)15-16-20(2,17)18/h3-10,15-16H,1-2H3
InChIKeyWUKWZYLLSZDJEH-UHFFFAOYSA-N
MW292.36 g/mol
LogP2.24
Rot. Bonds5

About N'-[4-(2-methoxyphenyl)phenyl]methanesulfonohydrazide

N'-[4-(2-methoxyphenyl)phenyl]methanesulfonohydrazide (PubChem CID 176904853) has the molecular formula C14H16N2O3S and a molecular weight of 292.36 g/mol. Its IUPAC name is N'-[4-(2-methoxyphenyl)phenyl]methanesulfonohydrazide.

Molecular Properties

Compound NameN'-[4-(2-methoxyphenyl)phenyl]methanesulfonohydrazide
PubChem CID176904853
Molecular FormulaC14H16N2O3S
Molecular Weight292.36 g/mol
Exact Mass292.09
IUPAC NameN'-[4-(2-methoxyphenyl)phenyl]methanesulfonohydrazide
SMILESCOc1ccccc1-c1ccc(NNS(C)(=O)=O)cc1
InChIInChI=1S/C14H16N2O3S/c1-19-14-6-4-3-5-13(14)11-7-9-12(10-8-11)15-16-20(2,17)18/h3-10,15-16H,1-2H3
InChIKeyWUKWZYLLSZDJEH-UHFFFAOYSA-N
XLogP2.24
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.36
LogP ≤ 52.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N'-[4-(2-methoxyphenyl)phenyl]methanesulfonohydrazide?
The IUPAC name of N'-[4-(2-methoxyphenyl)phenyl]methanesulfonohydrazide (CID 176904853) is N'-[4-(2-methoxyphenyl)phenyl]methanesulfonohydrazide.
What is the SMILES notation for N'-[4-(2-methoxyphenyl)phenyl]methanesulfonohydrazide?
The canonical SMILES for N'-[4-(2-methoxyphenyl)phenyl]methanesulfonohydrazide is COc1ccccc1-c1ccc(NNS(C)(=O)=O)cc1.
What is the InChIKey of N'-[4-(2-methoxyphenyl)phenyl]methanesulfonohydrazide?
The InChIKey is WUKWZYLLSZDJEH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N2O3S/c1-19-14-6-4-3-5-13(14)11-7-9-12(10-8-11)15-16-20(2,17)18/h3-10,15-16H,1-2H3.
What are the key properties of N'-[4-(2-methoxyphenyl)phenyl]methanesulfonohydrazide?
N'-[4-(2-methoxyphenyl)phenyl]methanesulfonohydrazide has a molecular weight of 292.36 g/mol, XLogP of 2.24, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N'-[4-(2-methoxyphenyl)phenyl]methanesulfonohydrazide is sourced from PubChem (CID 176904853), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).