5-(2-aminoethyl)-N,N-diethylthiophene-2-sulfonamide

C10H18N2O2S2 — CID 43420051

IUPAC5-(2-aminoethyl)-N,N-diethylthiophene-2-sulfonamide
SMILESCCN(CC)S(=O)(=O)c1ccc(CCN)s1
InChIInChI=1S/C10H18N2O2S2/c1-3-12(4-2)16(13,14)10-6-5-9(15-10)7-8-11/h5-6H,3-4,7-8,11H2,1-2H3
InChIKeyWSZQEGQNZQIXFR-UHFFFAOYSA-N
MW262.40 g/mol
LogP1.28
Rot. Bonds6

About 5-(2-aminoethyl)-N,N-diethylthiophene-2-sulfonamide

5-(2-aminoethyl)-N,N-diethylthiophene-2-sulfonamide (PubChem CID 43420051) has the molecular formula C10H18N2O2S2 and a molecular weight of 262.40 g/mol. Its IUPAC name is 5-(2-aminoethyl)-N,N-diethylthiophene-2-sulfonamide.

Molecular Properties

Compound Name5-(2-aminoethyl)-N,N-diethylthiophene-2-sulfonamide
PubChem CID43420051
Molecular FormulaC10H18N2O2S2
Molecular Weight262.40 g/mol
Exact Mass262.08
IUPAC Name5-(2-aminoethyl)-N,N-diethylthiophene-2-sulfonamide
SMILESCCN(CC)S(=O)(=O)c1ccc(CCN)s1
InChIInChI=1S/C10H18N2O2S2/c1-3-12(4-2)16(13,14)10-6-5-9(15-10)7-8-11/h5-6H,3-4,7-8,11H2,1-2H3
InChIKeyWSZQEGQNZQIXFR-UHFFFAOYSA-N
XLogP1.28
TPSA63.40 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.40
LogP ≤ 51.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-(2-aminoethyl)-N,N-diethylthiophene-2-sulfonamide?
The IUPAC name of 5-(2-aminoethyl)-N,N-diethylthiophene-2-sulfonamide (CID 43420051) is 5-(2-aminoethyl)-N,N-diethylthiophene-2-sulfonamide.
What is the SMILES notation for 5-(2-aminoethyl)-N,N-diethylthiophene-2-sulfonamide?
The canonical SMILES for 5-(2-aminoethyl)-N,N-diethylthiophene-2-sulfonamide is CCN(CC)S(=O)(=O)c1ccc(CCN)s1.
What is the InChIKey of 5-(2-aminoethyl)-N,N-diethylthiophene-2-sulfonamide?
The InChIKey is WSZQEGQNZQIXFR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N2O2S2/c1-3-12(4-2)16(13,14)10-6-5-9(15-10)7-8-11/h5-6H,3-4,7-8,11H2,1-2H3.
What are the key properties of 5-(2-aminoethyl)-N,N-diethylthiophene-2-sulfonamide?
5-(2-aminoethyl)-N,N-diethylthiophene-2-sulfonamide has a molecular weight of 262.40 g/mol, XLogP of 1.28, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-aminoethyl)-N,N-diethylthiophene-2-sulfonamide is sourced from PubChem (CID 43420051), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).