1-piperidin-3-yl-N-(2-thiophen-3-ylethyl)methanesulfonamide

C12H20N2O2S2 — CID 54972057

IUPAC1-piperidin-3-yl-N-(2-thiophen-3-ylethyl)methanesulfonamide
SMILESO=S(=O)(CC1CCCNC1)NCCc1ccsc1
InChIInChI=1S/C12H20N2O2S2/c15-18(16,10-12-2-1-5-13-8-12)14-6-3-11-4-7-17-9-11/h4,7,9,12-14H,1-3,5-6,8,10H2
InChIKeyOSZXVZACRRNZPC-UHFFFAOYSA-N
MW288.44 g/mol
LogP1.21
Rot. Bonds6

About 1-piperidin-3-yl-N-(2-thiophen-3-ylethyl)methanesulfonamide

1-piperidin-3-yl-N-(2-thiophen-3-ylethyl)methanesulfonamide (PubChem CID 54972057) has the molecular formula C12H20N2O2S2 and a molecular weight of 288.44 g/mol. Its IUPAC name is 1-piperidin-3-yl-N-(2-thiophen-3-ylethyl)methanesulfonamide.

Molecular Properties

Compound Name1-piperidin-3-yl-N-(2-thiophen-3-ylethyl)methanesulfonamide
PubChem CID54972057
Molecular FormulaC12H20N2O2S2
Molecular Weight288.44 g/mol
Exact Mass288.10
IUPAC Name1-piperidin-3-yl-N-(2-thiophen-3-ylethyl)methanesulfonamide
SMILESO=S(=O)(CC1CCCNC1)NCCc1ccsc1
InChIInChI=1S/C12H20N2O2S2/c15-18(16,10-12-2-1-5-13-8-12)14-6-3-11-4-7-17-9-11/h4,7,9,12-14H,1-3,5-6,8,10H2
InChIKeyOSZXVZACRRNZPC-UHFFFAOYSA-N
XLogP1.21
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.44
LogP ≤ 51.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

1-piperidin-3-yl-N-(thiophen-3-ylmethyl)methanesulfonamide
CID 55173705
N-[2-(furan-2-yl)ethyl]-1-piperidin-3-ylmethanesulfonamide
CID 54972407
3-(2-thiophen-3-ylethyl)azepane
CID 104680659
N-(2-piperidin-3-ylethyl)-3-thiophen-3-ylpropanamide;hydrochloride
CID 119555094
(3R)-N-(2-thiophen-3-ylethyl)piperidine-3-carboxamide
CID 81140487
1-piperidin-3-yl-N-(1,3-thiazol-4-ylmethyl)methanesulfonamide
CID 63823603
N-methyl-N-(piperidin-3-ylmethyl)-2-thiophen-3-ylethanamine
CID 106636462
N-[2-(4-methyl-1,2,4-triazol-3-yl)ethyl]-1-piperidin-3-ylmethanesulfonamide
CID 55201911
N-(cyclohexylmethyl)-1-piperidin-3-ylmethanesulfonamide
CID 54972626
2-piperidin-3-yl-N-(1-thiophen-3-ylpropan-2-yl)acetamide
CID 62676356
N-(2-cyclopentyloxyethyl)-1-piperidin-3-ylmethanesulfonamide
CID 63829038
N-pent-4-ynyl-1-piperidin-3-ylmethanesulfonamide
CID 106222713

Frequently Asked Questions

What is the IUPAC name of 1-piperidin-3-yl-N-(2-thiophen-3-ylethyl)methanesulfonamide?
The IUPAC name of 1-piperidin-3-yl-N-(2-thiophen-3-ylethyl)methanesulfonamide (CID 54972057) is 1-piperidin-3-yl-N-(2-thiophen-3-ylethyl)methanesulfonamide.
What is the SMILES notation for 1-piperidin-3-yl-N-(2-thiophen-3-ylethyl)methanesulfonamide?
The canonical SMILES for 1-piperidin-3-yl-N-(2-thiophen-3-ylethyl)methanesulfonamide is O=S(=O)(CC1CCCNC1)NCCc1ccsc1.
What is the InChIKey of 1-piperidin-3-yl-N-(2-thiophen-3-ylethyl)methanesulfonamide?
The InChIKey is OSZXVZACRRNZPC-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N2O2S2/c15-18(16,10-12-2-1-5-13-8-12)14-6-3-11-4-7-17-9-11/h4,7,9,12-14H,1-3,5-6,8,10H2.
What are the key properties of 1-piperidin-3-yl-N-(2-thiophen-3-ylethyl)methanesulfonamide?
1-piperidin-3-yl-N-(2-thiophen-3-ylethyl)methanesulfonamide has a molecular weight of 288.44 g/mol, XLogP of 1.21, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-piperidin-3-yl-N-(2-thiophen-3-ylethyl)methanesulfonamide is sourced from PubChem (CID 54972057), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).