N-(2-ethoxyethyl)-N-ethyl-2-(ethylamino)benzenesulfonamide

C14H24N2O3S — CID 63690094

IUPACN-(2-ethoxyethyl)-N-ethyl-2-(ethylamino)benzenesulfonamide
SMILESCCNc1ccccc1S(=O)(=O)N(CC)CCOCC
InChIInChI=1S/C14H24N2O3S/c1-4-15-13-9-7-8-10-14(13)20(17,18)16(5-2)11-12-19-6-3/h7-10,15H,4-6,11-12H2,1-3H3
InChIKeyUGHGSIZDLNCASN-UHFFFAOYSA-N
MW300.42 g/mol
LogP2.17
Rot. Bonds9

About N-(2-ethoxyethyl)-N-ethyl-2-(ethylamino)benzenesulfonamide

N-(2-ethoxyethyl)-N-ethyl-2-(ethylamino)benzenesulfonamide (PubChem CID 63690094) has the molecular formula C14H24N2O3S and a molecular weight of 300.42 g/mol. Its IUPAC name is N-(2-ethoxyethyl)-N-ethyl-2-(ethylamino)benzenesulfonamide.

Molecular Properties

Compound NameN-(2-ethoxyethyl)-N-ethyl-2-(ethylamino)benzenesulfonamide
PubChem CID63690094
Molecular FormulaC14H24N2O3S
Molecular Weight300.42 g/mol
Exact Mass300.15
IUPAC NameN-(2-ethoxyethyl)-N-ethyl-2-(ethylamino)benzenesulfonamide
SMILESCCNc1ccccc1S(=O)(=O)N(CC)CCOCC
InChIInChI=1S/C14H24N2O3S/c1-4-15-13-9-7-8-10-14(13)20(17,18)16(5-2)11-12-19-6-3/h7-10,15H,4-6,11-12H2,1-3H3
InChIKeyUGHGSIZDLNCASN-UHFFFAOYSA-N
XLogP2.17
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.42
LogP ≤ 52.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

2-chloro-N-(2-ethoxyethyl)-N-ethylpyridine-3-sulfonamide
CID 55226922
2-(3-aminoprop-1-ynyl)-N-(2-ethoxyethyl)-N-ethylbenzenesulfonamide
CID 63692385
5-bromo-N-(2-ethoxyethyl)-N-ethyl-2-(ethylamino)pyridine-3-sulfonamide
CID 63690095
2,4-dibromo-N-(2-ethoxyethyl)-N-ethylbenzenesulfonamide
CID 63691305
2-amino-5-chloro-N-(2-ethoxyethyl)-N-ethylbenzenesulfonamide
CID 63695936
N-(2-ethoxyethyl)-N-ethyl-4-(propylamino)benzenesulfonamide
CID 63692201
N-[3-(dimethylamino)propyl]-N-ethyl-2-(methylamino)benzenesulfonamide
CID 102996705
4-amino-2-chloro-N-(2-ethoxyethyl)-N-ethylbenzenesulfonamide
CID 63696287
2-amino-N-(2-ethoxyethyl)-N-ethyl-4-fluorobenzenesulfonamide
CID 63698233
1-N,1-N,2-N,2-N-tetraethylbenzene-1,2-disulfonamide
CID 3900555
N-[2-(diethylsulfamoyl)phenyl]formamide
CID 168651949
4-(bromomethyl)-N-(2-ethoxyethyl)-N-ethylbenzenesulfonamide
CID 65481240

Frequently Asked Questions

What is the IUPAC name of N-(2-ethoxyethyl)-N-ethyl-2-(ethylamino)benzenesulfonamide?
The IUPAC name of N-(2-ethoxyethyl)-N-ethyl-2-(ethylamino)benzenesulfonamide (CID 63690094) is N-(2-ethoxyethyl)-N-ethyl-2-(ethylamino)benzenesulfonamide.
What is the SMILES notation for N-(2-ethoxyethyl)-N-ethyl-2-(ethylamino)benzenesulfonamide?
The canonical SMILES for N-(2-ethoxyethyl)-N-ethyl-2-(ethylamino)benzenesulfonamide is CCNc1ccccc1S(=O)(=O)N(CC)CCOCC.
What is the InChIKey of N-(2-ethoxyethyl)-N-ethyl-2-(ethylamino)benzenesulfonamide?
The InChIKey is UGHGSIZDLNCASN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N2O3S/c1-4-15-13-9-7-8-10-14(13)20(17,18)16(5-2)11-12-19-6-3/h7-10,15H,4-6,11-12H2,1-3H3.
What are the key properties of N-(2-ethoxyethyl)-N-ethyl-2-(ethylamino)benzenesulfonamide?
N-(2-ethoxyethyl)-N-ethyl-2-(ethylamino)benzenesulfonamide has a molecular weight of 300.42 g/mol, XLogP of 2.17, 9 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-ethoxyethyl)-N-ethyl-2-(ethylamino)benzenesulfonamide is sourced from PubChem (CID 63690094), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).