5-(aminomethyl)-2-methyl-N-(2-piperidin-1-ylpropyl)thiophene-3-sulfonamide

C14H25N3O2S2 — CID 106015870

IUPAC5-(aminomethyl)-2-methyl-N-(2-piperidin-1-ylpropyl)thiophene-3-sulfonamide
SMILESCc1sc(CN)cc1S(=O)(=O)NCC(C)N1CCCCC1
InChIInChI=1S/C14H25N3O2S2/c1-11(17-6-4-3-5-7-17)10-16-21(18,19)14-8-13(9-15)20-12(14)2/h8,11,16H,3-7,9-10,15H2,1-2H3
InChIKeyYJGQUANWPXKVDY-UHFFFAOYSA-N
MW331.51 g/mol
LogP1.67
Rot. Bonds6

About 5-(aminomethyl)-2-methyl-N-(2-piperidin-1-ylpropyl)thiophene-3-sulfonamide

5-(aminomethyl)-2-methyl-N-(2-piperidin-1-ylpropyl)thiophene-3-sulfonamide (PubChem CID 106015870) has the molecular formula C14H25N3O2S2 and a molecular weight of 331.51 g/mol. Its IUPAC name is 5-(aminomethyl)-2-methyl-N-(2-piperidin-1-ylpropyl)thiophene-3-sulfonamide.

Molecular Properties

Compound Name5-(aminomethyl)-2-methyl-N-(2-piperidin-1-ylpropyl)thiophene-3-sulfonamide
PubChem CID106015870
Molecular FormulaC14H25N3O2S2
Molecular Weight331.51 g/mol
Exact Mass331.14
IUPAC Name5-(aminomethyl)-2-methyl-N-(2-piperidin-1-ylpropyl)thiophene-3-sulfonamide
SMILESCc1sc(CN)cc1S(=O)(=O)NCC(C)N1CCCCC1
InChIInChI=1S/C14H25N3O2S2/c1-11(17-6-4-3-5-7-17)10-16-21(18,19)14-8-13(9-15)20-12(14)2/h8,11,16H,3-7,9-10,15H2,1-2H3
InChIKeyYJGQUANWPXKVDY-UHFFFAOYSA-N
XLogP1.67
TPSA75.43 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500331.51
LogP ≤ 51.67
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

5-(aminomethyl)-N-(2-ethoxypropyl)-2-methylthiophene-3-sulfonamide
CID 106078844
2-(methylamino)-N-(2-piperidin-1-ylpropyl)benzenesulfonamide
CID 62152910
5-(aminomethyl)-N-(2-methoxy-2-methylpropyl)-2-methylthiophene-3-sulfonamide
CID 114142094
5-(aminomethyl)-N-[[1-(dimethylamino)cyclopentyl]methyl]-2-methylthiophene-3-sulfonamide
CID 106076875
5-(aminomethyl)-2-methyl-N-[2-(2-methylpropoxy)ethyl]thiophene-3-sulfonamide
CID 106085403
1-[1-(sulfamoylamino)propan-2-yl]piperidine
CID 112686143
5-(aminomethyl)-2-methyl-N-[(2-methylcyclopentyl)methyl]thiophene-3-sulfonamide
CID 106088377
4-bromo-2-fluoro-N-(2-piperidin-1-ylpropyl)benzenesulfonamide
CID 116528435
2-methyl-N-piperidin-1-yl-5-[(propan-2-ylamino)methyl]thiophene-3-sulfonamide
CID 106075307
N-[(3S)-3-(azepan-1-yl)butyl]-5-(4,5-dimethyl-1,3-thiazol-2-yl)-2-methylthiophene-3-sulfonamide
CID 92884490
5-(aminomethyl)-2-methyl-N-[2-(3-methylcyclohexyl)ethyl]thiophene-3-sulfonamide
CID 106067327
5-(aminomethyl)-N-(2,3-dihydro-1H-inden-5-yl)-2-methylthiophene-3-sulfonamide
CID 106059579

Frequently Asked Questions

What is the IUPAC name of 5-(aminomethyl)-2-methyl-N-(2-piperidin-1-ylpropyl)thiophene-3-sulfonamide?
The IUPAC name of 5-(aminomethyl)-2-methyl-N-(2-piperidin-1-ylpropyl)thiophene-3-sulfonamide (CID 106015870) is 5-(aminomethyl)-2-methyl-N-(2-piperidin-1-ylpropyl)thiophene-3-sulfonamide.
What is the SMILES notation for 5-(aminomethyl)-2-methyl-N-(2-piperidin-1-ylpropyl)thiophene-3-sulfonamide?
The canonical SMILES for 5-(aminomethyl)-2-methyl-N-(2-piperidin-1-ylpropyl)thiophene-3-sulfonamide is Cc1sc(CN)cc1S(=O)(=O)NCC(C)N1CCCCC1.
What is the InChIKey of 5-(aminomethyl)-2-methyl-N-(2-piperidin-1-ylpropyl)thiophene-3-sulfonamide?
The InChIKey is YJGQUANWPXKVDY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25N3O2S2/c1-11(17-6-4-3-5-7-17)10-16-21(18,19)14-8-13(9-15)20-12(14)2/h8,11,16H,3-7,9-10,15H2,1-2H3.
What are the key properties of 5-(aminomethyl)-2-methyl-N-(2-piperidin-1-ylpropyl)thiophene-3-sulfonamide?
5-(aminomethyl)-2-methyl-N-(2-piperidin-1-ylpropyl)thiophene-3-sulfonamide has a molecular weight of 331.51 g/mol, XLogP of 1.67, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(aminomethyl)-2-methyl-N-(2-piperidin-1-ylpropyl)thiophene-3-sulfonamide is sourced from PubChem (CID 106015870), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).