N-ethyl-2-(1-pyridin-2-ylethylamino)benzenesulfonamide

C15H19N3O2S — CID 43524451

IUPACN-ethyl-2-(1-pyridin-2-ylethylamino)benzenesulfonamide
SMILESCCNS(=O)(=O)c1ccccc1NC(C)c1ccccn1
InChIInChI=1S/C15H19N3O2S/c1-3-17-21(19,20)15-10-5-4-9-14(15)18-12(2)13-8-6-7-11-16-13/h4-12,17-18H,3H2,1-2H3
InChIKeyDQTBVHDCGXIJPV-UHFFFAOYSA-N
MW305.40 g/mol
LogP2.55
Rot. Bonds6

About N-ethyl-2-(1-pyridin-2-ylethylamino)benzenesulfonamide

N-ethyl-2-(1-pyridin-2-ylethylamino)benzenesulfonamide (PubChem CID 43524451) has the molecular formula C15H19N3O2S and a molecular weight of 305.40 g/mol. Its IUPAC name is N-ethyl-2-(1-pyridin-2-ylethylamino)benzenesulfonamide.

Molecular Properties

Compound NameN-ethyl-2-(1-pyridin-2-ylethylamino)benzenesulfonamide
PubChem CID43524451
Molecular FormulaC15H19N3O2S
Molecular Weight305.40 g/mol
Exact Mass305.12
IUPAC NameN-ethyl-2-(1-pyridin-2-ylethylamino)benzenesulfonamide
SMILESCCNS(=O)(=O)c1ccccc1NC(C)c1ccccn1
InChIInChI=1S/C15H19N3O2S/c1-3-17-21(19,20)15-10-5-4-9-14(15)18-12(2)13-8-6-7-11-16-13/h4-12,17-18H,3H2,1-2H3
InChIKeyDQTBVHDCGXIJPV-UHFFFAOYSA-N
XLogP2.55
TPSA71.09 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.40
LogP ≤ 52.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-[2-(ethylsulfamoyl)anilino]propanoic acid
CID 43468803
2-(ethylamino)-N-(1-pyridin-2-ylethyl)pyridine-3-sulfonamide
CID 62145879
2-ethoxy-N-(1-pyridin-2-ylethyl)aniline
CID 43191702
2-ethoxy-N-(1-pyridin-2-ylethyl)pyridin-3-amine
CID 43706285
N-ethyl-2-(2-hydroxypropylamino)benzenesulfonamide
CID 43500232
N-ethyl-2-hydrazinylbenzenesulfonamide
CID 43454365
2-chloro-N-(1-pyridin-2-ylethyl)pyridin-3-amine
CID 43689899
2,5-dimethyl-N-[2-[[(1R)-1-pyridin-2-ylethyl]amino]ethyl]thiophene-3-sulfonamide
CID 124514744
N-propyl-2-[1-(1H-1,2,4-triazol-5-yl)ethylamino]benzenesulfonamide
CID 106282881
N-[(1S)-1-pyridin-2-ylethyl]propane-1-sulfonamide
CID 78980226
2,3-dimethyl-N-(1-pyridin-2-ylethyl)aniline
CID 43196433
2-bromo-N-(1-pyridin-2-ylethyl)benzenesulfonamide
CID 46799998

Frequently Asked Questions

What is the IUPAC name of N-ethyl-2-(1-pyridin-2-ylethylamino)benzenesulfonamide?
The IUPAC name of N-ethyl-2-(1-pyridin-2-ylethylamino)benzenesulfonamide (CID 43524451) is N-ethyl-2-(1-pyridin-2-ylethylamino)benzenesulfonamide.
What is the SMILES notation for N-ethyl-2-(1-pyridin-2-ylethylamino)benzenesulfonamide?
The canonical SMILES for N-ethyl-2-(1-pyridin-2-ylethylamino)benzenesulfonamide is CCNS(=O)(=O)c1ccccc1NC(C)c1ccccn1.
What is the InChIKey of N-ethyl-2-(1-pyridin-2-ylethylamino)benzenesulfonamide?
The InChIKey is DQTBVHDCGXIJPV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3O2S/c1-3-17-21(19,20)15-10-5-4-9-14(15)18-12(2)13-8-6-7-11-16-13/h4-12,17-18H,3H2,1-2H3.
What are the key properties of N-ethyl-2-(1-pyridin-2-ylethylamino)benzenesulfonamide?
N-ethyl-2-(1-pyridin-2-ylethylamino)benzenesulfonamide has a molecular weight of 305.40 g/mol, XLogP of 2.55, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-(1-pyridin-2-ylethylamino)benzenesulfonamide is sourced from PubChem (CID 43524451), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).