N-[(3-chlorophenyl)methyl]-4-hydrazinyl-N-methylbenzenesulfonamide

C14H16ClN3O2S — CID 61417227

IUPACN-[(3-chlorophenyl)methyl]-4-hydrazinyl-N-methylbenzenesulfonamide
SMILESCN(Cc1cccc(Cl)c1)S(=O)(=O)c1ccc(NN)cc1
InChIInChI=1S/C14H16ClN3O2S/c1-18(10-11-3-2-4-12(15)9-11)21(19,20)14-7-5-13(17-16)6-8-14/h2-9,17H,10,16H2,1H3
InChIKeyGKVBUWVQTURIQE-UHFFFAOYSA-N
MW325.82 g/mol
LogP2.45
Rot. Bonds5

About N-[(3-chlorophenyl)methyl]-4-hydrazinyl-N-methylbenzenesulfonamide

N-[(3-chlorophenyl)methyl]-4-hydrazinyl-N-methylbenzenesulfonamide (PubChem CID 61417227) has the molecular formula C14H16ClN3O2S and a molecular weight of 325.82 g/mol. Its IUPAC name is N-[(3-chlorophenyl)methyl]-4-hydrazinyl-N-methylbenzenesulfonamide.

Molecular Properties

Compound NameN-[(3-chlorophenyl)methyl]-4-hydrazinyl-N-methylbenzenesulfonamide
PubChem CID61417227
Molecular FormulaC14H16ClN3O2S
Molecular Weight325.82 g/mol
Exact Mass325.07
IUPAC NameN-[(3-chlorophenyl)methyl]-4-hydrazinyl-N-methylbenzenesulfonamide
SMILESCN(Cc1cccc(Cl)c1)S(=O)(=O)c1ccc(NN)cc1
InChIInChI=1S/C14H16ClN3O2S/c1-18(10-11-3-2-4-12(15)9-11)21(19,20)14-7-5-13(17-16)6-8-14/h2-9,17H,10,16H2,1H3
InChIKeyGKVBUWVQTURIQE-UHFFFAOYSA-N
XLogP2.45
TPSA75.43 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.82
LogP ≤ 52.45
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze N-[(3-chlorophenyl)methyl]-4-hydrazinyl-N-methylbenzenesulfonamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[(3-chlorophenyl)methyl]-3-hydroxy-N-methylbenzenesulfonamide
CID 81258266
3-amino-N-[(3-chlorophenyl)methyl]-4-hydroxy-N-methylbenzenesulfonamide
CID 61105388
4-hydrazinyl-N-methyl-N-(thiophen-3-ylmethyl)benzenesulfonamide
CID 43528511
2-amino-N-[(3-chlorophenyl)methyl]-N-methylpyridine-4-sulfonamide
CID 62158182
6-amino-5-chloro-N-[(3-chlorophenyl)methyl]-N-methylpyridine-3-sulfonamide
CID 64602441
N-[(3-chlorophenyl)methyl]-N,2,3,5,6-pentamethylbenzenesulfonamide
CID 7937898
N-[4-[benzyl(methyl)sulfamoyl]phenyl]-2,5-dichlorobenzamide
CID 26899296
N-[(3-fluorophenyl)methyl]-N-methyl-4-methylsulfonylbenzenesulfonamide
CID 31534239
4-[benzyl(methyl)sulfamoyl]-N-(3,5-dichlorophenyl)benzamide
CID 23825383
N-(cyclopropylmethyl)-4-hydrazinyl-N-methylbenzenesulfonamide
CID 60985675
3-amino-N-[(4-chlorophenyl)methyl]-N-methylbenzenesulfonamide
CID 61105923
3-chloro-N-methyl-N-[(2-methylphenyl)methyl]benzenesulfonamide
CID 4796698

Frequently Asked Questions

What is the IUPAC name of N-[(3-chlorophenyl)methyl]-4-hydrazinyl-N-methylbenzenesulfonamide?
The IUPAC name of N-[(3-chlorophenyl)methyl]-4-hydrazinyl-N-methylbenzenesulfonamide (CID 61417227) is N-[(3-chlorophenyl)methyl]-4-hydrazinyl-N-methylbenzenesulfonamide.
What is the SMILES notation for N-[(3-chlorophenyl)methyl]-4-hydrazinyl-N-methylbenzenesulfonamide?
The canonical SMILES for N-[(3-chlorophenyl)methyl]-4-hydrazinyl-N-methylbenzenesulfonamide is CN(Cc1cccc(Cl)c1)S(=O)(=O)c1ccc(NN)cc1.
What is the InChIKey of N-[(3-chlorophenyl)methyl]-4-hydrazinyl-N-methylbenzenesulfonamide?
The InChIKey is GKVBUWVQTURIQE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16ClN3O2S/c1-18(10-11-3-2-4-12(15)9-11)21(19,20)14-7-5-13(17-16)6-8-14/h2-9,17H,10,16H2,1H3.
What are the key properties of N-[(3-chlorophenyl)methyl]-4-hydrazinyl-N-methylbenzenesulfonamide?
N-[(3-chlorophenyl)methyl]-4-hydrazinyl-N-methylbenzenesulfonamide has a molecular weight of 325.82 g/mol, XLogP of 2.45, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3-chlorophenyl)methyl]-4-hydrazinyl-N-methylbenzenesulfonamide is sourced from PubChem (CID 61417227), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).