N-(2-aminoethyl)-5-methyl-N-propan-2-ylthiophene-2-sulfonamide

C10H18N2O2S2 — CID 28708007

IUPACN-(2-aminoethyl)-5-methyl-N-propan-2-ylthiophene-2-sulfonamide
SMILESCc1ccc(S(=O)(=O)N(CCN)C(C)C)s1
InChIInChI=1S/C10H18N2O2S2/c1-8(2)12(7-6-11)16(13,14)10-5-4-9(3)15-10/h4-5,8H,6-7,11H2,1-3H3
InChIKeyJDWYJBQIONEXCK-UHFFFAOYSA-N
MW262.40 g/mol
LogP1.41
Rot. Bonds5

About N-(2-aminoethyl)-5-methyl-N-propan-2-ylthiophene-2-sulfonamide

N-(2-aminoethyl)-5-methyl-N-propan-2-ylthiophene-2-sulfonamide (PubChem CID 28708007) has the molecular formula C10H18N2O2S2 and a molecular weight of 262.40 g/mol. Its IUPAC name is N-(2-aminoethyl)-5-methyl-N-propan-2-ylthiophene-2-sulfonamide.

Molecular Properties

Compound NameN-(2-aminoethyl)-5-methyl-N-propan-2-ylthiophene-2-sulfonamide
PubChem CID28708007
Molecular FormulaC10H18N2O2S2
Molecular Weight262.40 g/mol
Exact Mass262.08
IUPAC NameN-(2-aminoethyl)-5-methyl-N-propan-2-ylthiophene-2-sulfonamide
SMILESCc1ccc(S(=O)(=O)N(CCN)C(C)C)s1
InChIInChI=1S/C10H18N2O2S2/c1-8(2)12(7-6-11)16(13,14)10-5-4-9(3)15-10/h4-5,8H,6-7,11H2,1-3H3
InChIKeyJDWYJBQIONEXCK-UHFFFAOYSA-N
XLogP1.41
TPSA63.40 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.40
LogP ≤ 51.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2-chloroethyl)-N-ethyl-5-methylthiophene-2-sulfonamide
CID 63397238
5-ethyl-N-(3-hydroxypropyl)-N-propan-2-ylthiophene-2-sulfonamide
CID 54947843
N-(2-hydroxyethyl)-5-methyl-N-propylthiophene-2-sulfonamide
CID 61424596
3-[(5-bromothiophen-2-yl)sulfonyl-propan-2-ylamino]-N'-hydroxypropanimidamide
CID 54996481
5-[butan-2-yl(ethyl)sulfamoyl]thiophene-2-carbothioamide
CID 106270318
N-(2-aminopropyl)-5-methylthiophene-2-sulfonamide
CID 63732116
N-ethyl-5-methyl-N-[2,2,2-trifluoro-1-(4-fluorophenyl)ethyl]thiophene-2-sulfonamide
CID 168899072
N-(2-aminoethyl)-3,5-dimethyl-N-propan-2-yl-1,2-oxazole-4-sulfonamide
CID 28708029
3-[ethyl-(5-methylthiophen-2-yl)sulfonylamino]-N'-hydroxypropanimidamide
CID 54992517
N-[(4-bromothiophen-2-yl)methyl]-N,5-dimethylthiophene-2-sulfonamide
CID 47318970
N-(2-aminoethyl)-N-propan-2-yl-2,3-dihydro-1H-indene-5-sulfonamide
CID 61348755
N-(cyanomethyl)-N-ethyl-5-methylthiophene-2-sulfonamide
CID 47813179

Frequently Asked Questions

What is the IUPAC name of N-(2-aminoethyl)-5-methyl-N-propan-2-ylthiophene-2-sulfonamide?
The IUPAC name of N-(2-aminoethyl)-5-methyl-N-propan-2-ylthiophene-2-sulfonamide (CID 28708007) is N-(2-aminoethyl)-5-methyl-N-propan-2-ylthiophene-2-sulfonamide.
What is the SMILES notation for N-(2-aminoethyl)-5-methyl-N-propan-2-ylthiophene-2-sulfonamide?
The canonical SMILES for N-(2-aminoethyl)-5-methyl-N-propan-2-ylthiophene-2-sulfonamide is Cc1ccc(S(=O)(=O)N(CCN)C(C)C)s1.
What is the InChIKey of N-(2-aminoethyl)-5-methyl-N-propan-2-ylthiophene-2-sulfonamide?
The InChIKey is JDWYJBQIONEXCK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N2O2S2/c1-8(2)12(7-6-11)16(13,14)10-5-4-9(3)15-10/h4-5,8H,6-7,11H2,1-3H3.
What are the key properties of N-(2-aminoethyl)-5-methyl-N-propan-2-ylthiophene-2-sulfonamide?
N-(2-aminoethyl)-5-methyl-N-propan-2-ylthiophene-2-sulfonamide has a molecular weight of 262.40 g/mol, XLogP of 1.41, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-aminoethyl)-5-methyl-N-propan-2-ylthiophene-2-sulfonamide is sourced from PubChem (CID 28708007), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).