N-[2-(dimethylamino)ethyl]-2,5-dimethylthiophene-3-sulfonamide;hydrochloride

C10H19ClN2O2S2 — CID 6602863

IUPACN-[2-(dimethylamino)ethyl]-2,5-dimethylthiophene-3-sulfonamide;hydrochloride
SMILESCc1cc(S(=O)(=O)NCCN(C)C)c(C)s1.Cl
InChIInChI=1S/C10H18N2O2S2.ClH/c1-8-7-10(9(2)15-8)16(13,14)11-5-6-12(3)4;/h7,11H,5-6H2,1-4H3;1H
InChIKeyNBGVGDFWDUDTQH-UHFFFAOYSA-N
MW298.86 g/mol
LogP1.63
Rot. Bonds5

About N-[2-(dimethylamino)ethyl]-2,5-dimethylthiophene-3-sulfonamide;hydrochloride

N-[2-(dimethylamino)ethyl]-2,5-dimethylthiophene-3-sulfonamide;hydrochloride (PubChem CID 6602863) has the molecular formula C10H19ClN2O2S2 and a molecular weight of 298.86 g/mol. Its IUPAC name is N-[2-(dimethylamino)ethyl]-2,5-dimethylthiophene-3-sulfonamide;hydrochloride.

Molecular Properties

Compound NameN-[2-(dimethylamino)ethyl]-2,5-dimethylthiophene-3-sulfonamide;hydrochloride
PubChem CID6602863
Molecular FormulaC10H19ClN2O2S2
Molecular Weight298.86 g/mol
Exact Mass298.06
IUPAC NameN-[2-(dimethylamino)ethyl]-2,5-dimethylthiophene-3-sulfonamide;hydrochloride
SMILESCc1cc(S(=O)(=O)NCCN(C)C)c(C)s1.Cl
InChIInChI=1S/C10H18N2O2S2.ClH/c1-8-7-10(9(2)15-8)16(13,14)11-5-6-12(3)4;/h7,11H,5-6H2,1-4H3;1H
InChIKeyNBGVGDFWDUDTQH-UHFFFAOYSA-N
XLogP1.63
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.86
LogP ≤ 51.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-cyclohexyl-2,5-dimethylthiophene-3-sulfonamide
CID 712013
2,5-dimethyl-N-(2-morpholin-4-ylethyl)thiophene-3-sulfonamide
CID 6602862
5-(2-aminoethyl)-N,N-diethylthiophene-2-sulfonamide
CID 43420051
5-(2-Aminoethyl)thiophene-2-sulfonamide hydrochloride
CID 20203298
N-(3-methoxypropyl)-2,5-dimethylthiophene-3-sulfonamide
CID 25503721
2,5-dimethyl-N-[2-(morpholin-4-yl)ethyl]thiophene-3-sulfonamide
CID 715945
1-[(2,5-Dimethylthiophen-3-yl)sulfonyl]piperazine hydrochloride
CID 47002261
N-(2-aminoethyl)-2,5-dimethylthiophene-3-sulfonamide hydrochloride
CID 71756742
N,2,5-trimethyl-3-thiophenesulfonamide
CID 39792150
N-[2-(Dimethylamino)ethyl]-2,5-dimethyl-3-thiophenesulfonamide
CID 717969
2-[(5-Ethylthiophen-2-yl)sulfonyl-methylamino]acetamide
CID 53511200
N-(cyanomethyl)-N,2,5-trimethylthiophene-3-sulfonamide
CID 75484819

Frequently Asked Questions

What is the IUPAC name of N-[2-(dimethylamino)ethyl]-2,5-dimethylthiophene-3-sulfonamide;hydrochloride?
The IUPAC name of N-[2-(dimethylamino)ethyl]-2,5-dimethylthiophene-3-sulfonamide;hydrochloride (CID 6602863) is N-[2-(dimethylamino)ethyl]-2,5-dimethylthiophene-3-sulfonamide;hydrochloride.
What is the SMILES notation for N-[2-(dimethylamino)ethyl]-2,5-dimethylthiophene-3-sulfonamide;hydrochloride?
The canonical SMILES for N-[2-(dimethylamino)ethyl]-2,5-dimethylthiophene-3-sulfonamide;hydrochloride is Cc1cc(S(=O)(=O)NCCN(C)C)c(C)s1.Cl.
What is the InChIKey of N-[2-(dimethylamino)ethyl]-2,5-dimethylthiophene-3-sulfonamide;hydrochloride?
The InChIKey is NBGVGDFWDUDTQH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N2O2S2.ClH/c1-8-7-10(9(2)15-8)16(13,14)11-5-6-12(3)4;/h7,11H,5-6H2,1-4H3;1H.
What are the key properties of N-[2-(dimethylamino)ethyl]-2,5-dimethylthiophene-3-sulfonamide;hydrochloride?
N-[2-(dimethylamino)ethyl]-2,5-dimethylthiophene-3-sulfonamide;hydrochloride has a molecular weight of 298.86 g/mol, XLogP of 1.63, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(dimethylamino)ethyl]-2,5-dimethylthiophene-3-sulfonamide;hydrochloride is sourced from PubChem (CID 6602863), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).