N-cyclopropyl-2-[4-(propylsulfonylamino)pyrazol-1-yl]acetamide

C11H18N4O3S — CID 61061294

IUPACN-cyclopropyl-2-[4-(propylsulfonylamino)pyrazol-1-yl]acetamide
SMILESCCCS(=O)(=O)Nc1cnn(CC(=O)NC2CC2)c1
InChIInChI=1S/C11H18N4O3S/c1-2-5-19(17,18)14-10-6-12-15(7-10)8-11(16)13-9-3-4-9/h6-7,9,14H,2-5,8H2,1H3,(H,13,16)
InChIKeyFVDIGVGVWFNNOX-UHFFFAOYSA-N
MW286.36 g/mol
LogP0.31
Rot. Bonds7

About N-cyclopropyl-2-[4-(propylsulfonylamino)pyrazol-1-yl]acetamide

N-cyclopropyl-2-[4-(propylsulfonylamino)pyrazol-1-yl]acetamide (PubChem CID 61061294) has the molecular formula C11H18N4O3S and a molecular weight of 286.36 g/mol. Its IUPAC name is N-cyclopropyl-2-[4-(propylsulfonylamino)pyrazol-1-yl]acetamide.

Molecular Properties

Compound NameN-cyclopropyl-2-[4-(propylsulfonylamino)pyrazol-1-yl]acetamide
PubChem CID61061294
Molecular FormulaC11H18N4O3S
Molecular Weight286.36 g/mol
Exact Mass286.11
IUPAC NameN-cyclopropyl-2-[4-(propylsulfonylamino)pyrazol-1-yl]acetamide
SMILESCCCS(=O)(=O)Nc1cnn(CC(=O)NC2CC2)c1
InChIInChI=1S/C11H18N4O3S/c1-2-5-19(17,18)14-10-6-12-15(7-10)8-11(16)13-9-3-4-9/h6-7,9,14H,2-5,8H2,1H3,(H,13,16)
InChIKeyFVDIGVGVWFNNOX-UHFFFAOYSA-N
XLogP0.31
TPSA93.09 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.36
LogP ≤ 50.31
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-2-[4-(propylsulfonylamino)pyrazol-1-yl]acetamide?
The IUPAC name of N-cyclopropyl-2-[4-(propylsulfonylamino)pyrazol-1-yl]acetamide (CID 61061294) is N-cyclopropyl-2-[4-(propylsulfonylamino)pyrazol-1-yl]acetamide.
What is the SMILES notation for N-cyclopropyl-2-[4-(propylsulfonylamino)pyrazol-1-yl]acetamide?
The canonical SMILES for N-cyclopropyl-2-[4-(propylsulfonylamino)pyrazol-1-yl]acetamide is CCCS(=O)(=O)Nc1cnn(CC(=O)NC2CC2)c1.
What is the InChIKey of N-cyclopropyl-2-[4-(propylsulfonylamino)pyrazol-1-yl]acetamide?
The InChIKey is FVDIGVGVWFNNOX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N4O3S/c1-2-5-19(17,18)14-10-6-12-15(7-10)8-11(16)13-9-3-4-9/h6-7,9,14H,2-5,8H2,1H3,(H,13,16).
What are the key properties of N-cyclopropyl-2-[4-(propylsulfonylamino)pyrazol-1-yl]acetamide?
N-cyclopropyl-2-[4-(propylsulfonylamino)pyrazol-1-yl]acetamide has a molecular weight of 286.36 g/mol, XLogP of 0.31, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-2-[4-(propylsulfonylamino)pyrazol-1-yl]acetamide is sourced from PubChem (CID 61061294), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).