2-(ethylamino)-N-(thiophen-2-ylmethyl)benzenesulfonamide

C13H16N2O2S2 — CID 62143225

IUPAC2-(ethylamino)-N-(thiophen-2-ylmethyl)benzenesulfonamide
SMILESCCNc1ccccc1S(=O)(=O)NCc1cccs1
InChIInChI=1S/C13H16N2O2S2/c1-2-14-12-7-3-4-8-13(12)19(16,17)15-10-11-6-5-9-18-11/h3-9,14-15H,2,10H2,1H3
InChIKeyZFIIJNYFHPKRTH-UHFFFAOYSA-N
MW296.42 g/mol
LogP2.66
Rot. Bonds6

About 2-(ethylamino)-N-(thiophen-2-ylmethyl)benzenesulfonamide

2-(ethylamino)-N-(thiophen-2-ylmethyl)benzenesulfonamide (PubChem CID 62143225) has the molecular formula C13H16N2O2S2 and a molecular weight of 296.42 g/mol. Its IUPAC name is 2-(ethylamino)-N-(thiophen-2-ylmethyl)benzenesulfonamide.

Molecular Properties

Compound Name2-(ethylamino)-N-(thiophen-2-ylmethyl)benzenesulfonamide
PubChem CID62143225
Molecular FormulaC13H16N2O2S2
Molecular Weight296.42 g/mol
Exact Mass296.07
IUPAC Name2-(ethylamino)-N-(thiophen-2-ylmethyl)benzenesulfonamide
SMILESCCNc1ccccc1S(=O)(=O)NCc1cccs1
InChIInChI=1S/C13H16N2O2S2/c1-2-14-12-7-3-4-8-13(12)19(16,17)15-10-11-6-5-9-18-11/h3-9,14-15H,2,10H2,1H3
InChIKeyZFIIJNYFHPKRTH-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-methyl-2-(thiophen-2-ylmethylamino)benzenesulfonamide
CID 43383430
N-benzyl-2-(ethylamino)benzenesulfonamide
CID 62148548
N-[(4-bromophenyl)methyl]-2-(ethylamino)benzenesulfonamide
CID 62150324
N-ethyl-5-methyl-4-(thiophen-2-ylmethylsulfamoyl)thiophene-2-carboxamide
CID 6503006
4-bromo-N-(thiophen-2-ylmethyl)naphthalene-1-sulfonamide
CID 35582526
2-(ethylamino)-N-[(3-methylphenyl)methyl]benzenesulfonamide
CID 62146693
2-(ethylamino)-N-pentylbenzenesulfonamide
CID 62162464
5-ethyl-2-methoxy-N-(thiophen-2-ylmethyl)benzenesulfonamide
CID 9267842
3-methylsulfonyl-N-(thiophen-2-ylmethyl)benzenesulfonamide
CID 47154675
N-[2-(diethylamino)ethyl]-2-(ethylamino)benzenesulfonamide
CID 62150418
2,4-dimethoxy-N-(thiophen-2-ylmethyl)benzenesulfonamide
CID 19682467
2-(ethylamino)-N-(oxolan-3-ylmethyl)benzenesulfonamide
CID 55119396

Frequently Asked Questions

What is the IUPAC name of 2-(ethylamino)-N-(thiophen-2-ylmethyl)benzenesulfonamide?
The IUPAC name of 2-(ethylamino)-N-(thiophen-2-ylmethyl)benzenesulfonamide (CID 62143225) is 2-(ethylamino)-N-(thiophen-2-ylmethyl)benzenesulfonamide.
What is the SMILES notation for 2-(ethylamino)-N-(thiophen-2-ylmethyl)benzenesulfonamide?
The canonical SMILES for 2-(ethylamino)-N-(thiophen-2-ylmethyl)benzenesulfonamide is CCNc1ccccc1S(=O)(=O)NCc1cccs1.
What is the InChIKey of 2-(ethylamino)-N-(thiophen-2-ylmethyl)benzenesulfonamide?
The InChIKey is ZFIIJNYFHPKRTH-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16N2O2S2/c1-2-14-12-7-3-4-8-13(12)19(16,17)15-10-11-6-5-9-18-11/h3-9,14-15H,2,10H2,1H3.
What are the key properties of 2-(ethylamino)-N-(thiophen-2-ylmethyl)benzenesulfonamide?
2-(ethylamino)-N-(thiophen-2-ylmethyl)benzenesulfonamide 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 2-(ethylamino)-N-(thiophen-2-ylmethyl)benzenesulfonamide is sourced from PubChem (CID 62143225), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).