N-[4-[1-(ethylamino)ethyl]phenyl]thiophene-2-sulfonamide

C14H18N2O2S2 — CID 43508090

IUPACN-[4-[1-(ethylamino)ethyl]phenyl]thiophene-2-sulfonamide
SMILESCCNC(C)c1ccc(NS(=O)(=O)c2cccs2)cc1
InChIInChI=1S/C14H18N2O2S2/c1-3-15-11(2)12-6-8-13(9-7-12)16-20(17,18)14-5-4-10-19-14/h4-11,15-16H,3H2,1-2H3
InChIKeyRVDDGCVSPSZQGK-UHFFFAOYSA-N
MW310.44 g/mol
LogP3.22
Rot. Bonds6

About N-[4-[1-(ethylamino)ethyl]phenyl]thiophene-2-sulfonamide

N-[4-[1-(ethylamino)ethyl]phenyl]thiophene-2-sulfonamide (PubChem CID 43508090) has the molecular formula C14H18N2O2S2 and a molecular weight of 310.44 g/mol. Its IUPAC name is N-[4-[1-(ethylamino)ethyl]phenyl]thiophene-2-sulfonamide.

Molecular Properties

Compound NameN-[4-[1-(ethylamino)ethyl]phenyl]thiophene-2-sulfonamide
PubChem CID43508090
Molecular FormulaC14H18N2O2S2
Molecular Weight310.44 g/mol
Exact Mass310.08
IUPAC NameN-[4-[1-(ethylamino)ethyl]phenyl]thiophene-2-sulfonamide
SMILESCCNC(C)c1ccc(NS(=O)(=O)c2cccs2)cc1
InChIInChI=1S/C14H18N2O2S2/c1-3-15-11(2)12-6-8-13(9-7-12)16-20(17,18)14-5-4-10-19-14/h4-11,15-16H,3H2,1-2H3
InChIKeyRVDDGCVSPSZQGK-UHFFFAOYSA-N
XLogP3.22
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.44
LogP ≤ 53.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[4-(1-hydroxyethyl)phenyl]thiophene-2-sulfonamide
CID 43416696
N-(4-propan-2-yloxyphenyl)thiophene-2-sulfonamide
CID 5002728
N-[1-(4-propan-2-ylphenyl)ethyl]thiophene-2-sulfonamide
CID 22201168
N-[4-(4-ethoxyanilino)phenyl]thiophene-2-sulfonamide
CID 112987709
N-[4-(1-methoxypropan-2-ylsulfamoyl)phenyl]thiophene-2-sulfonamide
CID 42998818
N-[4-[(4-methylphenyl)sulfamoyl]phenyl]thiophene-2-sulfonamide
CID 1075762
N-[2-[(2R)-butan-2-yl]phenyl]thiophene-2-sulfonamide
CID 7949986
N-[(1R)-1-(4-methylphenyl)propyl]-4-(thiophen-2-ylsulfonylamino)benzamide
CID 41248781
[(2R)-1-[4-[(2S)-butan-2-yl]anilino]-1-oxopropan-2-yl] 4-(thiophen-2-ylsulfonylamino)benzoate
CID 26916539
[(2R)-1-[4-[(2R)-butan-2-yl]anilino]-1-oxopropan-2-yl] 4-(thiophen-2-ylsulfonylamino)benzoate
CID 26916538
N-[4-[1-(ethylamino)ethyl]phenyl]cyclopropanesulfonamide
CID 64553467
N-[4-[2-(dimethylamino)ethylamino]phenyl]thiophene-2-sulfonamide
CID 112981383

Frequently Asked Questions

What is the IUPAC name of N-[4-[1-(ethylamino)ethyl]phenyl]thiophene-2-sulfonamide?
The IUPAC name of N-[4-[1-(ethylamino)ethyl]phenyl]thiophene-2-sulfonamide (CID 43508090) is N-[4-[1-(ethylamino)ethyl]phenyl]thiophene-2-sulfonamide.
What is the SMILES notation for N-[4-[1-(ethylamino)ethyl]phenyl]thiophene-2-sulfonamide?
The canonical SMILES for N-[4-[1-(ethylamino)ethyl]phenyl]thiophene-2-sulfonamide is CCNC(C)c1ccc(NS(=O)(=O)c2cccs2)cc1.
What is the InChIKey of N-[4-[1-(ethylamino)ethyl]phenyl]thiophene-2-sulfonamide?
The InChIKey is RVDDGCVSPSZQGK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N2O2S2/c1-3-15-11(2)12-6-8-13(9-7-12)16-20(17,18)14-5-4-10-19-14/h4-11,15-16H,3H2,1-2H3.
What are the key properties of N-[4-[1-(ethylamino)ethyl]phenyl]thiophene-2-sulfonamide?
N-[4-[1-(ethylamino)ethyl]phenyl]thiophene-2-sulfonamide has a molecular weight of 310.44 g/mol, XLogP of 3.22, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[1-(ethylamino)ethyl]phenyl]thiophene-2-sulfonamide is sourced from PubChem (CID 43508090), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).