N-[(2,4-dichlorophenyl)methylideneamino]methanesulfonamide

C8H8Cl2N2O2S — CID 867204

IUPACN-[(2,4-dichlorophenyl)methylideneamino]methanesulfonamide
SMILESCS(=O)(=O)NN=Cc1ccc(Cl)cc1Cl
InChIInChI=1S/C8H8Cl2N2O2S/c1-15(13,14)12-11-5-6-2-3-7(9)4-8(6)10/h2-5,12H,1H3
InChIKeyJNBSEGUPZZJMMZ-UHFFFAOYSA-N
MW267.14 g/mol
LogP1.88
Rot. Bonds3

About N-[(2,4-dichlorophenyl)methylideneamino]methanesulfonamide

N-[(2,4-dichlorophenyl)methylideneamino]methanesulfonamide (PubChem CID 867204) has the molecular formula C8H8Cl2N2O2S and a molecular weight of 267.14 g/mol. Its IUPAC name is N-[(2,4-dichlorophenyl)methylideneamino]methanesulfonamide.

Molecular Properties

Compound NameN-[(2,4-dichlorophenyl)methylideneamino]methanesulfonamide
PubChem CID867204
Molecular FormulaC8H8Cl2N2O2S
Molecular Weight267.14 g/mol
Exact Mass265.97
IUPAC NameN-[(2,4-dichlorophenyl)methylideneamino]methanesulfonamide
SMILESCS(=O)(=O)NN=Cc1ccc(Cl)cc1Cl
InChIInChI=1S/C8H8Cl2N2O2S/c1-15(13,14)12-11-5-6-2-3-7(9)4-8(6)10/h2-5,12H,1H3
InChIKeyJNBSEGUPZZJMMZ-UHFFFAOYSA-N
XLogP1.88
TPSA58.53 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.14
LogP ≤ 51.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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

N-[(2,4-dichlorophenyl)methylideneamino]-4-methylbenzenesulfonamide
CID 668213
N-[(Z)-(2,4-dichlorophenyl)methylideneamino]benzenesulfonamide
CID 5387404
N-[(2,4-dichlorophenyl)methylideneamino]methanamine
CID 67650124
N-[(2,4-dichlorophenyl)methylideneamino]-2,5-dimethylbenzenesulfonamide
CID 4017599
N-[(Z)-(2,4-dichlorophenyl)methylideneamino]acetamide
CID 6162520
N-[(E)-(2,4-dichlorophenyl)methylideneamino]-4-ethoxybenzenesulfonamide
CID 6908616
[(2,4-dichlorophenyl)methylideneamino]carbamic acid
CID 70469242
4-[2-[(2,4-dichlorophenyl)methylidene]hydrazinyl]benzenesulfonamide
CID 50883758
N-[(3-bromo-5-chloro-2-hydroxyphenyl)methylideneamino]methanesulfonamide
CID 727419
1-N,4-N-bis[(E)-(2,4-dichlorophenyl)methylideneamino]benzene-1,4-dicarboxamide
CID 6894297
acetic acid;N'-[(2E)-2-[(2,4-dichlorophenyl)methylidene]hydrazinyl]methanimidamide
CID 20849549
1,2-diamino-3-[(E)-(2,4-dichlorophenyl)methylideneamino]guanidine
CID 155130444

Frequently Asked Questions

What is the IUPAC name of N-[(2,4-dichlorophenyl)methylideneamino]methanesulfonamide?
The IUPAC name of N-[(2,4-dichlorophenyl)methylideneamino]methanesulfonamide (CID 867204) is N-[(2,4-dichlorophenyl)methylideneamino]methanesulfonamide.
What is the SMILES notation for N-[(2,4-dichlorophenyl)methylideneamino]methanesulfonamide?
The canonical SMILES for N-[(2,4-dichlorophenyl)methylideneamino]methanesulfonamide is CS(=O)(=O)NN=Cc1ccc(Cl)cc1Cl.
What is the InChIKey of N-[(2,4-dichlorophenyl)methylideneamino]methanesulfonamide?
The InChIKey is JNBSEGUPZZJMMZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8Cl2N2O2S/c1-15(13,14)12-11-5-6-2-3-7(9)4-8(6)10/h2-5,12H,1H3.
What are the key properties of N-[(2,4-dichlorophenyl)methylideneamino]methanesulfonamide?
N-[(2,4-dichlorophenyl)methylideneamino]methanesulfonamide has a molecular weight of 267.14 g/mol, XLogP of 1.88, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2,4-dichlorophenyl)methylideneamino]methanesulfonamide is sourced from PubChem (CID 867204), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).