N-(2-pyridin-2-ylpropan-2-yl)thiophene-2-sulfonamide

C12H14N2O2S2 — CID 110870510

IUPACN-(2-pyridin-2-ylpropan-2-yl)thiophene-2-sulfonamide
SMILESCC(C)(NS(=O)(=O)c1cccs1)c1ccccn1
InChIInChI=1S/C12H14N2O2S2/c1-12(2,10-6-3-4-8-13-10)14-18(15,16)11-7-5-9-17-11/h3-9,14H,1-2H3
InChIKeyXAAIGDIIXPDNLI-UHFFFAOYSA-N
MW282.39 g/mol
LogP2.36
Rot. Bonds4

About N-(2-pyridin-2-ylpropan-2-yl)thiophene-2-sulfonamide

N-(2-pyridin-2-ylpropan-2-yl)thiophene-2-sulfonamide (PubChem CID 110870510) has the molecular formula C12H14N2O2S2 and a molecular weight of 282.39 g/mol. Its IUPAC name is N-(2-pyridin-2-ylpropan-2-yl)thiophene-2-sulfonamide.

Molecular Properties

Compound NameN-(2-pyridin-2-ylpropan-2-yl)thiophene-2-sulfonamide
PubChem CID110870510
Molecular FormulaC12H14N2O2S2
Molecular Weight282.39 g/mol
Exact Mass282.05
IUPAC NameN-(2-pyridin-2-ylpropan-2-yl)thiophene-2-sulfonamide
SMILESCC(C)(NS(=O)(=O)c1cccs1)c1ccccn1
InChIInChI=1S/C12H14N2O2S2/c1-12(2,10-6-3-4-8-13-10)14-18(15,16)11-7-5-9-17-11/h3-9,14H,1-2H3
InChIKeyXAAIGDIIXPDNLI-UHFFFAOYSA-N
XLogP2.36
TPSA59.06 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.39
LogP ≤ 52.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(2-pyridin-2-ylpropan-2-yl)thiophene-2-sulfonamide?
The IUPAC name of N-(2-pyridin-2-ylpropan-2-yl)thiophene-2-sulfonamide (CID 110870510) is N-(2-pyridin-2-ylpropan-2-yl)thiophene-2-sulfonamide.
What is the SMILES notation for N-(2-pyridin-2-ylpropan-2-yl)thiophene-2-sulfonamide?
The canonical SMILES for N-(2-pyridin-2-ylpropan-2-yl)thiophene-2-sulfonamide is CC(C)(NS(=O)(=O)c1cccs1)c1ccccn1.
What is the InChIKey of N-(2-pyridin-2-ylpropan-2-yl)thiophene-2-sulfonamide?
The InChIKey is XAAIGDIIXPDNLI-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N2O2S2/c1-12(2,10-6-3-4-8-13-10)14-18(15,16)11-7-5-9-17-11/h3-9,14H,1-2H3.
What are the key properties of N-(2-pyridin-2-ylpropan-2-yl)thiophene-2-sulfonamide?
N-(2-pyridin-2-ylpropan-2-yl)thiophene-2-sulfonamide has a molecular weight of 282.39 g/mol, XLogP of 2.36, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-pyridin-2-ylpropan-2-yl)thiophene-2-sulfonamide is sourced from PubChem (CID 110870510), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).