5-(methylaminomethyl)-N-(3-methylcyclopentyl)thiophene-2-sulfonamide

C12H20N2O2S2 — CID 114551883

IUPAC5-(methylaminomethyl)-N-(3-methylcyclopentyl)thiophene-2-sulfonamide
SMILESCNCc1ccc(S(=O)(=O)NC2CCC(C)C2)s1
InChIInChI=1S/C12H20N2O2S2/c1-9-3-4-10(7-9)14-18(15,16)12-6-5-11(17-12)8-13-2/h5-6,9-10,13-14H,3-4,7-8H2,1-2H3
InChIKeyWTFXFFCBNWMTSO-UHFFFAOYSA-N
MW288.44 g/mol
LogP1.93
Rot. Bonds5

About 5-(methylaminomethyl)-N-(3-methylcyclopentyl)thiophene-2-sulfonamide

5-(methylaminomethyl)-N-(3-methylcyclopentyl)thiophene-2-sulfonamide (PubChem CID 114551883) has the molecular formula C12H20N2O2S2 and a molecular weight of 288.44 g/mol. Its IUPAC name is 5-(methylaminomethyl)-N-(3-methylcyclopentyl)thiophene-2-sulfonamide.

Molecular Properties

Compound Name5-(methylaminomethyl)-N-(3-methylcyclopentyl)thiophene-2-sulfonamide
PubChem CID114551883
Molecular FormulaC12H20N2O2S2
Molecular Weight288.44 g/mol
Exact Mass288.10
IUPAC Name5-(methylaminomethyl)-N-(3-methylcyclopentyl)thiophene-2-sulfonamide
SMILESCNCc1ccc(S(=O)(=O)NC2CCC(C)C2)s1
InChIInChI=1S/C12H20N2O2S2/c1-9-3-4-10(7-9)14-18(15,16)12-6-5-11(17-12)8-13-2/h5-6,9-10,13-14H,3-4,7-8H2,1-2H3
InChIKeyWTFXFFCBNWMTSO-UHFFFAOYSA-N
XLogP1.93
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.44
LogP ≤ 51.93
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

5-(methylaminomethyl)-N-(4-propylcyclohexyl)thiophene-2-sulfonamide
CID 106054466
5-(methylaminomethyl)-N-(oxolan-3-yl)thiophene-2-sulfonamide
CID 106072321
5-(methylaminomethyl)-N-(oxan-3-yl)thiophene-2-sulfonamide
CID 106065205
N-(2,3-dihydro-1H-inden-2-yl)-5-(methylaminomethyl)thiophene-2-sulfonamide
CID 106087833
N-cyclopropyl-5-ethylthiophene-2-sulfonamide
CID 61061009
2-(methylaminomethyl)-N-(3-methylcyclopentyl)benzenesulfonamide
CID 114551992
2-[5-[(3-methylcyclobutyl)sulfamoyl]thiophen-2-yl]acetic acid
CID 113467124
5-(2-aminoethyl)-N-(3,5-dimethylcyclohexyl)thiophene-2-sulfonamide
CID 64734291
N-(2,2-dimethylcyclohexyl)-5-(methylaminomethyl)thiophene-2-sulfonamide
CID 106071372
5-cyano-N-(3-methylcyclohexyl)thiophene-2-sulfonamide
CID 106267297
1-[5-(3,4-dimethylpyrrolidin-1-yl)sulfonylthiophen-2-yl]-N-methylmethanamine
CID 79187627
2-methyl-N-(3-methylcyclopentyl)-1,3-thiazole-5-sulfonamide
CID 105058414

Frequently Asked Questions

What is the IUPAC name of 5-(methylaminomethyl)-N-(3-methylcyclopentyl)thiophene-2-sulfonamide?
The IUPAC name of 5-(methylaminomethyl)-N-(3-methylcyclopentyl)thiophene-2-sulfonamide (CID 114551883) is 5-(methylaminomethyl)-N-(3-methylcyclopentyl)thiophene-2-sulfonamide.
What is the SMILES notation for 5-(methylaminomethyl)-N-(3-methylcyclopentyl)thiophene-2-sulfonamide?
The canonical SMILES for 5-(methylaminomethyl)-N-(3-methylcyclopentyl)thiophene-2-sulfonamide is CNCc1ccc(S(=O)(=O)NC2CCC(C)C2)s1.
What is the InChIKey of 5-(methylaminomethyl)-N-(3-methylcyclopentyl)thiophene-2-sulfonamide?
The InChIKey is WTFXFFCBNWMTSO-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N2O2S2/c1-9-3-4-10(7-9)14-18(15,16)12-6-5-11(17-12)8-13-2/h5-6,9-10,13-14H,3-4,7-8H2,1-2H3.
What are the key properties of 5-(methylaminomethyl)-N-(3-methylcyclopentyl)thiophene-2-sulfonamide?
5-(methylaminomethyl)-N-(3-methylcyclopentyl)thiophene-2-sulfonamide has a molecular weight of 288.44 g/mol, XLogP of 1.93, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(methylaminomethyl)-N-(3-methylcyclopentyl)thiophene-2-sulfonamide is sourced from PubChem (CID 114551883), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).