N-[(2-ethoxyphenyl)methylideneamino]benzenesulfonamide

C15H16N2O3S — CID 2643075

IUPACN-[(2-ethoxyphenyl)methylideneamino]benzenesulfonamide
SMILESCCOc1ccccc1C=NNS(=O)(=O)c1ccccc1
InChIInChI=1S/C15H16N2O3S/c1-2-20-15-11-7-6-8-13(15)12-16-17-21(18,19)14-9-4-3-5-10-14/h3-12,17H,2H2,1H3
InChIKeyDJUNJXGNYIISCZ-UHFFFAOYSA-N
MW304.37 g/mol
LogP2.40
Rot. Bonds6

About N-[(2-ethoxyphenyl)methylideneamino]benzenesulfonamide

N-[(2-ethoxyphenyl)methylideneamino]benzenesulfonamide (PubChem CID 2643075) has the molecular formula C15H16N2O3S and a molecular weight of 304.37 g/mol. Its IUPAC name is N-[(2-ethoxyphenyl)methylideneamino]benzenesulfonamide.

Molecular Properties

Compound NameN-[(2-ethoxyphenyl)methylideneamino]benzenesulfonamide
PubChem CID2643075
Molecular FormulaC15H16N2O3S
Molecular Weight304.37 g/mol
Exact Mass304.09
IUPAC NameN-[(2-ethoxyphenyl)methylideneamino]benzenesulfonamide
SMILESCCOc1ccccc1C=NNS(=O)(=O)c1ccccc1
InChIInChI=1S/C15H16N2O3S/c1-2-20-15-11-7-6-8-13(15)12-16-17-21(18,19)14-9-4-3-5-10-14/h3-12,17H,2H2,1H3
InChIKeyDJUNJXGNYIISCZ-UHFFFAOYSA-N
XLogP2.40
TPSA67.76 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.37
LogP ≤ 52.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

4-ethoxy-N-[(2-ethoxyphenyl)methylideneamino]benzenesulfonamide
CID 2643189
N-[(Z)-(2-propoxyphenyl)methylideneamino]benzenesulfonamide
CID 6116874
N-[(3-ethoxy-2-hydroxyphenyl)methylideneamino]benzenesulfonamide
CID 2551534
N-[(E)-[2-(2-methylpropoxy)phenyl]methylideneamino]benzenesulfonamide
CID 110509597
N-[[2-[(4-fluorophenyl)methoxy]phenyl]methylideneamino]benzenesulfonamide
CID 4992291
4-bromo-N-[(E)-(3-ethoxy-2-methoxyphenyl)methylideneamino]benzenesulfonamide
CID 110516039
N-[(E)-(3-ethoxy-4-hydroxyphenyl)methylideneamino]benzenesulfonamide
CID 135738480
N-[(E)-(3-ethoxy-2-hydroxyphenyl)methylideneamino]-4-methoxybenzenesulfonamide
CID 135958060
4-chloro-N-[(E)-[2-(2-methylpropoxy)phenyl]methylideneamino]benzenesulfonamide
CID 110516226
4-ethoxy-N-[(E)-(2-ethoxy-3-methoxyphenyl)methylideneamino]benzenesulfonamide
CID 110516667
N-[(Z)-[2-(difluoromethoxy)-3-ethoxyphenyl]methylideneamino]-4-methylbenzenesulfonamide
CID 9073491
N-[(Z)-(3-ethoxy-2-hydroxyphenyl)methylideneamino]-4-(2-methylpropyl)benzenesulfonamide
CID 135647683

Frequently Asked Questions

What is the IUPAC name of N-[(2-ethoxyphenyl)methylideneamino]benzenesulfonamide?
The IUPAC name of N-[(2-ethoxyphenyl)methylideneamino]benzenesulfonamide (CID 2643075) is N-[(2-ethoxyphenyl)methylideneamino]benzenesulfonamide.
What is the SMILES notation for N-[(2-ethoxyphenyl)methylideneamino]benzenesulfonamide?
The canonical SMILES for N-[(2-ethoxyphenyl)methylideneamino]benzenesulfonamide is CCOc1ccccc1C=NNS(=O)(=O)c1ccccc1.
What is the InChIKey of N-[(2-ethoxyphenyl)methylideneamino]benzenesulfonamide?
The InChIKey is DJUNJXGNYIISCZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N2O3S/c1-2-20-15-11-7-6-8-13(15)12-16-17-21(18,19)14-9-4-3-5-10-14/h3-12,17H,2H2,1H3.
What are the key properties of N-[(2-ethoxyphenyl)methylideneamino]benzenesulfonamide?
N-[(2-ethoxyphenyl)methylideneamino]benzenesulfonamide has a molecular weight of 304.37 g/mol, XLogP of 2.40, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-ethoxyphenyl)methylideneamino]benzenesulfonamide is sourced from PubChem (CID 2643075), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).