N-[2-(ethylaminomethyl)phenyl]thiophene-2-sulfonamide

C13H16N2O2S2 — CID 43606461

IUPACN-[2-(ethylaminomethyl)phenyl]thiophene-2-sulfonamide
SMILESCCNCc1ccccc1NS(=O)(=O)c1cccs1
InChIInChI=1S/C13H16N2O2S2/c1-2-14-10-11-6-3-4-7-12(11)15-19(16,17)13-8-5-9-18-13/h3-9,14-15H,2,10H2,1H3
InChIKeyYWOWAJLALLJNCV-UHFFFAOYSA-N
MW296.42 g/mol
LogP2.66
Rot. Bonds6

About N-[2-(ethylaminomethyl)phenyl]thiophene-2-sulfonamide

N-[2-(ethylaminomethyl)phenyl]thiophene-2-sulfonamide (PubChem CID 43606461) has the molecular formula C13H16N2O2S2 and a molecular weight of 296.42 g/mol. Its IUPAC name is N-[2-(ethylaminomethyl)phenyl]thiophene-2-sulfonamide.

Molecular Properties

Compound NameN-[2-(ethylaminomethyl)phenyl]thiophene-2-sulfonamide
PubChem CID43606461
Molecular FormulaC13H16N2O2S2
Molecular Weight296.42 g/mol
Exact Mass296.07
IUPAC NameN-[2-(ethylaminomethyl)phenyl]thiophene-2-sulfonamide
SMILESCCNCc1ccccc1NS(=O)(=O)c1cccs1
InChIInChI=1S/C13H16N2O2S2/c1-2-14-10-11-6-3-4-7-12(11)15-19(16,17)13-8-5-9-18-13/h3-9,14-15H,2,10H2,1H3
InChIKeyYWOWAJLALLJNCV-UHFFFAOYSA-N
XLogP2.66
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.42
LogP ≤ 52.66
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[4-[[2-[(2-cyclopropylpropylamino)methyl]phenyl]sulfamoyl]phenyl]thiophene-2-sulfonamide
CID 69154834
N-[2-[(2R)-butan-2-yl]phenyl]thiophene-2-sulfonamide
CID 7949986
N-(2-tert-butylphenyl)thiophene-2-sulfonamide
CID 3861926
2-(thiophen-2-ylsulfonylamino)benzamide
CID 769135
N-[2-(ethylaminomethyl)phenyl]-1-phenylmethanesulfonamide
CID 43606467
N-[2-(ethylamino)ethyl]thiophene-2-sulfonamide;hydrochloride
CID 119973565
N-(2-ethyl-6-methylphenyl)-2-(thiophen-2-ylsulfonylamino)benzenecarboximidate
CID 2336215
butyl 2-(thiophen-2-ylsulfonylamino)benzoate
CID 18157559
diethyl 2-[[2-(thiophen-2-ylsulfonylamino)anilino]methylidene]propanedioate
CID 2322174
N-[2-(ethylamino)ethyl]-2-(thiophen-2-ylsulfonylamino)acetamide
CID 119507324
1-propan-2-yl-3-[2-(thiophen-2-ylsulfonylamino)phenyl]thiourea
CID 25039011
N-[2-[(3-pyridin-4-yl-1,2,4-oxadiazol-5-yl)methyl]phenyl]thiophene-2-sulfonamide
CID 90563140

Frequently Asked Questions

What is the IUPAC name of N-[2-(ethylaminomethyl)phenyl]thiophene-2-sulfonamide?
The IUPAC name of N-[2-(ethylaminomethyl)phenyl]thiophene-2-sulfonamide (CID 43606461) is N-[2-(ethylaminomethyl)phenyl]thiophene-2-sulfonamide.
What is the SMILES notation for N-[2-(ethylaminomethyl)phenyl]thiophene-2-sulfonamide?
The canonical SMILES for N-[2-(ethylaminomethyl)phenyl]thiophene-2-sulfonamide is CCNCc1ccccc1NS(=O)(=O)c1cccs1.
What is the InChIKey of N-[2-(ethylaminomethyl)phenyl]thiophene-2-sulfonamide?
The InChIKey is YWOWAJLALLJNCV-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16N2O2S2/c1-2-14-10-11-6-3-4-7-12(11)15-19(16,17)13-8-5-9-18-13/h3-9,14-15H,2,10H2,1H3.
What are the key properties of N-[2-(ethylaminomethyl)phenyl]thiophene-2-sulfonamide?
N-[2-(ethylaminomethyl)phenyl]thiophene-2-sulfonamide has a molecular weight of 296.42 g/mol, XLogP of 2.66, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(ethylaminomethyl)phenyl]thiophene-2-sulfonamide is sourced from PubChem (CID 43606461), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).