N-[2-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)ethyl]-1H-pyrazole-4-sulfonamide

C10H13N5O3S — CID 131929095

IUPACN-[2-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)ethyl]-1H-pyrazole-4-sulfonamide
SMILESO=S(=O)(NCCc1nc(C2CC2)no1)c1cn[nH]c1
InChIInChI=1S/C10H13N5O3S/c16-19(17,8-5-11-12-6-8)13-4-3-9-14-10(15-18-9)7-1-2-7/h5-7,13H,1-4H2,(H,11,12)
InChIKeyLCUPAPLZZMOCHI-UHFFFAOYSA-N
MW283.31 g/mol
LogP0.19
Rot. Bonds6

About N-[2-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)ethyl]-1H-pyrazole-4-sulfonamide

N-[2-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)ethyl]-1H-pyrazole-4-sulfonamide (PubChem CID 131929095) has the molecular formula C10H13N5O3S and a molecular weight of 283.31 g/mol. Its IUPAC name is N-[2-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)ethyl]-1H-pyrazole-4-sulfonamide.

Molecular Properties

Compound NameN-[2-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)ethyl]-1H-pyrazole-4-sulfonamide
PubChem CID131929095
Molecular FormulaC10H13N5O3S
Molecular Weight283.31 g/mol
Exact Mass283.07
IUPAC NameN-[2-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)ethyl]-1H-pyrazole-4-sulfonamide
SMILESO=S(=O)(NCCc1nc(C2CC2)no1)c1cn[nH]c1
InChIInChI=1S/C10H13N5O3S/c16-19(17,8-5-11-12-6-8)13-4-3-9-14-10(15-18-9)7-1-2-7/h5-7,13H,1-4H2,(H,11,12)
InChIKeyLCUPAPLZZMOCHI-UHFFFAOYSA-N
XLogP0.19
TPSA113.77 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.31
LogP ≤ 50.19
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-[2-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)ethyl]-1H-pyrazole-4-sulfonamide?
The IUPAC name of N-[2-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)ethyl]-1H-pyrazole-4-sulfonamide (CID 131929095) is N-[2-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)ethyl]-1H-pyrazole-4-sulfonamide.
What is the SMILES notation for N-[2-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)ethyl]-1H-pyrazole-4-sulfonamide?
The canonical SMILES for N-[2-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)ethyl]-1H-pyrazole-4-sulfonamide is O=S(=O)(NCCc1nc(C2CC2)no1)c1cn[nH]c1.
What is the InChIKey of N-[2-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)ethyl]-1H-pyrazole-4-sulfonamide?
The InChIKey is LCUPAPLZZMOCHI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13N5O3S/c16-19(17,8-5-11-12-6-8)13-4-3-9-14-10(15-18-9)7-1-2-7/h5-7,13H,1-4H2,(H,11,12).
What are the key properties of N-[2-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)ethyl]-1H-pyrazole-4-sulfonamide?
N-[2-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)ethyl]-1H-pyrazole-4-sulfonamide has a molecular weight of 283.31 g/mol, XLogP of 0.19, 6 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)ethyl]-1H-pyrazole-4-sulfonamide is sourced from PubChem (CID 131929095), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).