N-[(1-methylpiperidin-3-yl)methyl]thiophene-2-sulfonamide

C11H18N2O2S2 — CID 142818973

IUPACN-[(1-methylpiperidin-3-yl)methyl]thiophene-2-sulfonamide
SMILESCN1CCCC(CNS(=O)(=O)c2cccs2)C1
InChIInChI=1S/C11H18N2O2S2/c1-13-6-2-4-10(9-13)8-12-17(14,15)11-5-3-7-16-11/h3,5,7,10,12H,2,4,6,8-9H2,1H3
InChIKeyAGBJKUMCBALZRO-UHFFFAOYSA-N
MW274.41 g/mol
LogP1.37
Rot. Bonds4

About N-[(1-methylpiperidin-3-yl)methyl]thiophene-2-sulfonamide

N-[(1-methylpiperidin-3-yl)methyl]thiophene-2-sulfonamide (PubChem CID 142818973) has the molecular formula C11H18N2O2S2 and a molecular weight of 274.41 g/mol. Its IUPAC name is N-[(1-methylpiperidin-3-yl)methyl]thiophene-2-sulfonamide.

Molecular Properties

Compound NameN-[(1-methylpiperidin-3-yl)methyl]thiophene-2-sulfonamide
PubChem CID142818973
Molecular FormulaC11H18N2O2S2
Molecular Weight274.41 g/mol
Exact Mass274.08
IUPAC NameN-[(1-methylpiperidin-3-yl)methyl]thiophene-2-sulfonamide
SMILESCN1CCCC(CNS(=O)(=O)c2cccs2)C1
InChIInChI=1S/C11H18N2O2S2/c1-13-6-2-4-10(9-13)8-12-17(14,15)11-5-3-7-16-11/h3,5,7,10,12H,2,4,6,8-9H2,1H3
InChIKeyAGBJKUMCBALZRO-UHFFFAOYSA-N
XLogP1.37
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.41
LogP ≤ 51.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[[(3R)-1-(4-methylpiperazine-1-carbonyl)piperidin-3-yl]methyl]thiophene-2-sulfonamide
CID 97274825
N-[(1-methyl-5-oxopyrrolidin-3-yl)methyl]thiophene-2-sulfonamide
CID 110737130
N-[[(3R)-1-(3-phenylpropanoyl)piperidin-3-yl]methyl]thiophene-2-sulfonamide
CID 42475731
N-[[1-(4-thiophen-2-ylbutanoyl)piperidin-3-yl]methyl]thiophene-2-sulfonamide
CID 45252310
5-cyano-N-[(1-methylpiperidin-3-yl)methyl]thiophene-2-sulfonamide
CID 106267926
N,N-dimethyl-4-[(thiophen-2-ylsulfonylamino)methyl]piperidine-1-sulfonamide
CID 131702793
2-(methylaminomethyl)-N-[(1-methylpiperidin-3-yl)methyl]thiophene-3-sulfonamide
CID 106050570
N-[[1-[(1-methylpyrazol-4-yl)methyl]pyrrolidin-3-yl]methyl]thiophene-2-sulfonamide
CID 56760043
N-[(4-hydroxycyclohexyl)methyl]thiophene-2-sulfonamide
CID 114147059
N-[[(3R)-1-[2-[(4-methyl-1,3-thiazol-2-yl)sulfanyl]acetyl]piperidin-3-yl]methyl]thiophene-2-sulfonamide
CID 25489580
2-(methylamino)-N-[(1-methylpiperidin-3-yl)methyl]benzenesulfonamide
CID 62159127
N-[(3-hydroxycyclobutyl)methyl]thiophene-2-sulfonamide
CID 66006317

Frequently Asked Questions

What is the IUPAC name of N-[(1-methylpiperidin-3-yl)methyl]thiophene-2-sulfonamide?
The IUPAC name of N-[(1-methylpiperidin-3-yl)methyl]thiophene-2-sulfonamide (CID 142818973) is N-[(1-methylpiperidin-3-yl)methyl]thiophene-2-sulfonamide.
What is the SMILES notation for N-[(1-methylpiperidin-3-yl)methyl]thiophene-2-sulfonamide?
The canonical SMILES for N-[(1-methylpiperidin-3-yl)methyl]thiophene-2-sulfonamide is CN1CCCC(CNS(=O)(=O)c2cccs2)C1.
What is the InChIKey of N-[(1-methylpiperidin-3-yl)methyl]thiophene-2-sulfonamide?
The InChIKey is AGBJKUMCBALZRO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N2O2S2/c1-13-6-2-4-10(9-13)8-12-17(14,15)11-5-3-7-16-11/h3,5,7,10,12H,2,4,6,8-9H2,1H3.
What are the key properties of N-[(1-methylpiperidin-3-yl)methyl]thiophene-2-sulfonamide?
N-[(1-methylpiperidin-3-yl)methyl]thiophene-2-sulfonamide has a molecular weight of 274.41 g/mol, XLogP of 1.37, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1-methylpiperidin-3-yl)methyl]thiophene-2-sulfonamide is sourced from PubChem (CID 142818973), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).