N-[(3R)-piperidin-3-yl]thiophene-2-sulfonamide

C9H14N2O2S2 — CID 71645820

IUPACN-[(3R)-piperidin-3-yl]thiophene-2-sulfonamide
SMILESO=S(=O)(N[C@@H]1CCCNC1)c1cccs1
InChIInChI=1S/C9H14N2O2S2/c12-15(13,9-4-2-6-14-9)11-8-3-1-5-10-7-8/h2,4,6,8,10-11H,1,3,5,7H2/t8-/m1/s1
InChIKeyPQMOBQUPCCGTIY-MRVPVSSYSA-N
MW246.36 g/mol
LogP0.78
Rot. Bonds3

About N-[(3R)-piperidin-3-yl]thiophene-2-sulfonamide

N-[(3R)-piperidin-3-yl]thiophene-2-sulfonamide (PubChem CID 71645820) has the molecular formula C9H14N2O2S2 and a molecular weight of 246.36 g/mol. Its IUPAC name is N-[(3R)-piperidin-3-yl]thiophene-2-sulfonamide.

Molecular Properties

Compound NameN-[(3R)-piperidin-3-yl]thiophene-2-sulfonamide
PubChem CID71645820
Molecular FormulaC9H14N2O2S2
Molecular Weight246.36 g/mol
Exact Mass246.05
IUPAC NameN-[(3R)-piperidin-3-yl]thiophene-2-sulfonamide
SMILESO=S(=O)(N[C@@H]1CCCNC1)c1cccs1
InChIInChI=1S/C9H14N2O2S2/c12-15(13,9-4-2-6-14-9)11-8-3-1-5-10-7-8/h2,4,6,8,10-11H,1,3,5,7H2/t8-/m1/s1
InChIKeyPQMOBQUPCCGTIY-MRVPVSSYSA-N
XLogP0.78
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.36
LogP ≤ 50.78
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[(3R)-piperidin-3-yl]thiophene-2-sulfonamide?
The IUPAC name of N-[(3R)-piperidin-3-yl]thiophene-2-sulfonamide (CID 71645820) is N-[(3R)-piperidin-3-yl]thiophene-2-sulfonamide.
What is the SMILES notation for N-[(3R)-piperidin-3-yl]thiophene-2-sulfonamide?
The canonical SMILES for N-[(3R)-piperidin-3-yl]thiophene-2-sulfonamide is O=S(=O)(N[C@@H]1CCCNC1)c1cccs1.
What is the InChIKey of N-[(3R)-piperidin-3-yl]thiophene-2-sulfonamide?
The InChIKey is PQMOBQUPCCGTIY-MRVPVSSYSA-N. The full InChI is InChI=1S/C9H14N2O2S2/c12-15(13,9-4-2-6-14-9)11-8-3-1-5-10-7-8/h2,4,6,8,10-11H,1,3,5,7H2/t8-/m1/s1.
What are the key properties of N-[(3R)-piperidin-3-yl]thiophene-2-sulfonamide?
N-[(3R)-piperidin-3-yl]thiophene-2-sulfonamide has a molecular weight of 246.36 g/mol, XLogP of 0.78, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3R)-piperidin-3-yl]thiophene-2-sulfonamide is sourced from PubChem (CID 71645820), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).