N-(ethylsulfamoyl)-2-(2-phenyl-1,3-thiazol-4-yl)ethanamine

C13H17N3O2S2 — CID 110624843

IUPACN-(ethylsulfamoyl)-2-(2-phenyl-1,3-thiazol-4-yl)ethanamine
SMILESCCNS(=O)(=O)NCCc1csc(-c2ccccc2)n1
InChIInChI=1S/C13H17N3O2S2/c1-2-14-20(17,18)15-9-8-12-10-19-13(16-12)11-6-4-3-5-7-11/h3-7,10,14-15H,2,8-9H2,1H3
InChIKeyXAHCYDHVMIXDLH-UHFFFAOYSA-N
MW311.43 g/mol
LogP1.80
Rot. Bonds7

About N-(ethylsulfamoyl)-2-(2-phenyl-1,3-thiazol-4-yl)ethanamine

N-(ethylsulfamoyl)-2-(2-phenyl-1,3-thiazol-4-yl)ethanamine (PubChem CID 110624843) has the molecular formula C13H17N3O2S2 and a molecular weight of 311.43 g/mol. Its IUPAC name is N-(ethylsulfamoyl)-2-(2-phenyl-1,3-thiazol-4-yl)ethanamine.

Molecular Properties

Compound NameN-(ethylsulfamoyl)-2-(2-phenyl-1,3-thiazol-4-yl)ethanamine
PubChem CID110624843
Molecular FormulaC13H17N3O2S2
Molecular Weight311.43 g/mol
Exact Mass311.08
IUPAC NameN-(ethylsulfamoyl)-2-(2-phenyl-1,3-thiazol-4-yl)ethanamine
SMILESCCNS(=O)(=O)NCCc1csc(-c2ccccc2)n1
InChIInChI=1S/C13H17N3O2S2/c1-2-14-20(17,18)15-9-8-12-10-19-13(16-12)11-6-4-3-5-7-11/h3-7,10,14-15H,2,8-9H2,1H3
InChIKeyXAHCYDHVMIXDLH-UHFFFAOYSA-N
XLogP1.80
TPSA71.09 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500311.43
LogP ≤ 51.80
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze N-(ethylsulfamoyl)-2-(2-phenyl-1,3-thiazol-4-yl)ethanamine 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-(ethylsulfamoyl)-2-(2-pyridin-2-yl-1,3-thiazol-4-yl)ethanamine
CID 110624920
2-methoxy-N-[2-(2-phenyl-1,3-thiazol-4-yl)ethyl]ethanesulfonamide
CID 110305114
4-chloro-N-[2-(2-phenyl-1,3-thiazol-4-yl)ethyl]benzenesulfonamide
CID 2386160
N-[2-[2-(4-methylphenyl)-1,3-thiazol-4-yl]ethyl]methanesulfonamide
CID 51106179
(2S)-2-methylsulfonyl-N-[2-(2-phenyl-1,3-thiazol-4-yl)ethyl]propanamide
CID 97030329
4-ethyl-2-phenyl-1,3-thiazole
CID 5324799
N-[2-[2-(4-chlorophenyl)-1,3-thiazol-4-yl]ethyl]-2-phenylethanesulfonamide
CID 7216713
ethane;4-ethyl-2-phenyl-1,3-thiazole
CID 91427044
4-ethyl-2-phenyl-1,3-thiazole;dihydrochloride
CID 118514483
2-methyl-1-[2-(2-phenyl-1,3-thiazol-4-yl)ethyl]guanidine
CID 111975161
N-[2-[2-(4-fluorophenyl)-1,3-thiazol-4-yl]ethyl]-1-(2-methylphenyl)methanesulfonamide
CID 110317221
2,4-bis(methylsulfonyl)-N-[2-(2-phenyl-1,3-thiazol-4-yl)ethyl]aniline
CID 133348701

Frequently Asked Questions

What is the IUPAC name of N-(ethylsulfamoyl)-2-(2-phenyl-1,3-thiazol-4-yl)ethanamine?
The IUPAC name of N-(ethylsulfamoyl)-2-(2-phenyl-1,3-thiazol-4-yl)ethanamine (CID 110624843) is N-(ethylsulfamoyl)-2-(2-phenyl-1,3-thiazol-4-yl)ethanamine.
What is the SMILES notation for N-(ethylsulfamoyl)-2-(2-phenyl-1,3-thiazol-4-yl)ethanamine?
The canonical SMILES for N-(ethylsulfamoyl)-2-(2-phenyl-1,3-thiazol-4-yl)ethanamine is CCNS(=O)(=O)NCCc1csc(-c2ccccc2)n1.
What is the InChIKey of N-(ethylsulfamoyl)-2-(2-phenyl-1,3-thiazol-4-yl)ethanamine?
The InChIKey is XAHCYDHVMIXDLH-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17N3O2S2/c1-2-14-20(17,18)15-9-8-12-10-19-13(16-12)11-6-4-3-5-7-11/h3-7,10,14-15H,2,8-9H2,1H3.
What are the key properties of N-(ethylsulfamoyl)-2-(2-phenyl-1,3-thiazol-4-yl)ethanamine?
N-(ethylsulfamoyl)-2-(2-phenyl-1,3-thiazol-4-yl)ethanamine has a molecular weight of 311.43 g/mol, XLogP of 1.80, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(ethylsulfamoyl)-2-(2-phenyl-1,3-thiazol-4-yl)ethanamine is sourced from PubChem (CID 110624843), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).