N-[2-(2-pyrazol-1-yl-1,3-thiazol-4-yl)ethyl]cyclopropanesulfonamide

C11H14N4O2S2 — CID 71802254

IUPACN-[2-(2-pyrazol-1-yl-1,3-thiazol-4-yl)ethyl]cyclopropanesulfonamide
SMILESO=S(=O)(NCCc1csc(-n2cccn2)n1)C1CC1
InChIInChI=1S/C11H14N4O2S2/c16-19(17,10-2-3-10)13-6-4-9-8-18-11(14-9)15-7-1-5-12-15/h1,5,7-8,10,13H,2-4,6H2
InChIKeyLVNYHMOHZOWXJB-UHFFFAOYSA-N
MW298.39 g/mol
LogP0.95
Rot. Bonds6

About N-[2-(2-pyrazol-1-yl-1,3-thiazol-4-yl)ethyl]cyclopropanesulfonamide

N-[2-(2-pyrazol-1-yl-1,3-thiazol-4-yl)ethyl]cyclopropanesulfonamide (PubChem CID 71802254) has the molecular formula C11H14N4O2S2 and a molecular weight of 298.39 g/mol. Its IUPAC name is N-[2-(2-pyrazol-1-yl-1,3-thiazol-4-yl)ethyl]cyclopropanesulfonamide.

Molecular Properties

Compound NameN-[2-(2-pyrazol-1-yl-1,3-thiazol-4-yl)ethyl]cyclopropanesulfonamide
PubChem CID71802254
Molecular FormulaC11H14N4O2S2
Molecular Weight298.39 g/mol
Exact Mass298.06
IUPAC NameN-[2-(2-pyrazol-1-yl-1,3-thiazol-4-yl)ethyl]cyclopropanesulfonamide
SMILESO=S(=O)(NCCc1csc(-n2cccn2)n1)C1CC1
InChIInChI=1S/C11H14N4O2S2/c16-19(17,10-2-3-10)13-6-4-9-8-18-11(14-9)15-7-1-5-12-15/h1,5,7-8,10,13H,2-4,6H2
InChIKeyLVNYHMOHZOWXJB-UHFFFAOYSA-N
XLogP0.95
TPSA76.88 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.39
LogP ≤ 50.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-[2-(2-pyrazol-1-yl-1,3-thiazol-4-yl)ethyl]cyclopropanesulfonamide?
The IUPAC name of N-[2-(2-pyrazol-1-yl-1,3-thiazol-4-yl)ethyl]cyclopropanesulfonamide (CID 71802254) is N-[2-(2-pyrazol-1-yl-1,3-thiazol-4-yl)ethyl]cyclopropanesulfonamide.
What is the SMILES notation for N-[2-(2-pyrazol-1-yl-1,3-thiazol-4-yl)ethyl]cyclopropanesulfonamide?
The canonical SMILES for N-[2-(2-pyrazol-1-yl-1,3-thiazol-4-yl)ethyl]cyclopropanesulfonamide is O=S(=O)(NCCc1csc(-n2cccn2)n1)C1CC1.
What is the InChIKey of N-[2-(2-pyrazol-1-yl-1,3-thiazol-4-yl)ethyl]cyclopropanesulfonamide?
The InChIKey is LVNYHMOHZOWXJB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N4O2S2/c16-19(17,10-2-3-10)13-6-4-9-8-18-11(14-9)15-7-1-5-12-15/h1,5,7-8,10,13H,2-4,6H2.
What are the key properties of N-[2-(2-pyrazol-1-yl-1,3-thiazol-4-yl)ethyl]cyclopropanesulfonamide?
N-[2-(2-pyrazol-1-yl-1,3-thiazol-4-yl)ethyl]cyclopropanesulfonamide has a molecular weight of 298.39 g/mol, XLogP of 0.95, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(2-pyrazol-1-yl-1,3-thiazol-4-yl)ethyl]cyclopropanesulfonamide is sourced from PubChem (CID 71802254), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).