1-ethyl-3,5-dimethyl-N-(5-methyl-2-propylpyrazol-3-yl)pyrazole-4-sulfonamide

C14H23N5O2S — CID 71688193

IUPAC1-ethyl-3,5-dimethyl-N-(5-methyl-2-propylpyrazol-3-yl)pyrazole-4-sulfonamide
SMILESCCCn1nc(C)cc1NS(=O)(=O)c1c(C)nn(CC)c1C
InChIInChI=1S/C14H23N5O2S/c1-6-8-19-13(9-10(3)15-19)17-22(20,21)14-11(4)16-18(7-2)12(14)5/h9,17H,6-8H2,1-5H3
InChIKeyFVXAPLWFJRQGMK-UHFFFAOYSA-N
MW325.44 g/mol
LogP2.24
Rot. Bonds6

About 1-ethyl-3,5-dimethyl-N-(5-methyl-2-propylpyrazol-3-yl)pyrazole-4-sulfonamide

1-ethyl-3,5-dimethyl-N-(5-methyl-2-propylpyrazol-3-yl)pyrazole-4-sulfonamide (PubChem CID 71688193) has the molecular formula C14H23N5O2S and a molecular weight of 325.44 g/mol. Its IUPAC name is 1-ethyl-3,5-dimethyl-N-(5-methyl-2-propylpyrazol-3-yl)pyrazole-4-sulfonamide.

Molecular Properties

Compound Name1-ethyl-3,5-dimethyl-N-(5-methyl-2-propylpyrazol-3-yl)pyrazole-4-sulfonamide
PubChem CID71688193
Molecular FormulaC14H23N5O2S
Molecular Weight325.44 g/mol
Exact Mass325.16
IUPAC Name1-ethyl-3,5-dimethyl-N-(5-methyl-2-propylpyrazol-3-yl)pyrazole-4-sulfonamide
SMILESCCCn1nc(C)cc1NS(=O)(=O)c1c(C)nn(CC)c1C
InChIInChI=1S/C14H23N5O2S/c1-6-8-19-13(9-10(3)15-19)17-22(20,21)14-11(4)16-18(7-2)12(14)5/h9,17H,6-8H2,1-5H3
InChIKeyFVXAPLWFJRQGMK-UHFFFAOYSA-N
XLogP2.24
TPSA81.81 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.44
LogP ≤ 52.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 1-ethyl-3,5-dimethyl-N-(5-methyl-2-propylpyrazol-3-yl)pyrazole-4-sulfonamide?
The IUPAC name of 1-ethyl-3,5-dimethyl-N-(5-methyl-2-propylpyrazol-3-yl)pyrazole-4-sulfonamide (CID 71688193) is 1-ethyl-3,5-dimethyl-N-(5-methyl-2-propylpyrazol-3-yl)pyrazole-4-sulfonamide.
What is the SMILES notation for 1-ethyl-3,5-dimethyl-N-(5-methyl-2-propylpyrazol-3-yl)pyrazole-4-sulfonamide?
The canonical SMILES for 1-ethyl-3,5-dimethyl-N-(5-methyl-2-propylpyrazol-3-yl)pyrazole-4-sulfonamide is CCCn1nc(C)cc1NS(=O)(=O)c1c(C)nn(CC)c1C.
What is the InChIKey of 1-ethyl-3,5-dimethyl-N-(5-methyl-2-propylpyrazol-3-yl)pyrazole-4-sulfonamide?
The InChIKey is FVXAPLWFJRQGMK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N5O2S/c1-6-8-19-13(9-10(3)15-19)17-22(20,21)14-11(4)16-18(7-2)12(14)5/h9,17H,6-8H2,1-5H3.
What are the key properties of 1-ethyl-3,5-dimethyl-N-(5-methyl-2-propylpyrazol-3-yl)pyrazole-4-sulfonamide?
1-ethyl-3,5-dimethyl-N-(5-methyl-2-propylpyrazol-3-yl)pyrazole-4-sulfonamide has a molecular weight of 325.44 g/mol, XLogP of 2.24, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-3,5-dimethyl-N-(5-methyl-2-propylpyrazol-3-yl)pyrazole-4-sulfonamide is sourced from PubChem (CID 71688193), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).