1-ethyl-5-methyl-N-pyridin-3-ylpyrazole-4-sulfonamide

C11H14N4O2S — CID 6470411

IUPAC1-ethyl-5-methyl-N-pyridin-3-ylpyrazole-4-sulfonamide
SMILESCCn1ncc(S(=O)(=O)Nc2cccnc2)c1C
InChIInChI=1S/C11H14N4O2S/c1-3-15-9(2)11(8-13-15)18(16,17)14-10-5-4-6-12-7-10/h4-8,14H,3H2,1-2H3
InChIKeyUAQODIPXMZKAJH-UHFFFAOYSA-N
MW266.33 g/mol
LogP1.41
Rot. Bonds4

About 1-ethyl-5-methyl-N-pyridin-3-ylpyrazole-4-sulfonamide

1-ethyl-5-methyl-N-pyridin-3-ylpyrazole-4-sulfonamide (PubChem CID 6470411) has the molecular formula C11H14N4O2S and a molecular weight of 266.33 g/mol. Its IUPAC name is 1-ethyl-5-methyl-N-pyridin-3-ylpyrazole-4-sulfonamide.

Molecular Properties

Compound Name1-ethyl-5-methyl-N-pyridin-3-ylpyrazole-4-sulfonamide
PubChem CID6470411
Molecular FormulaC11H14N4O2S
Molecular Weight266.33 g/mol
Exact Mass266.08
IUPAC Name1-ethyl-5-methyl-N-pyridin-3-ylpyrazole-4-sulfonamide
SMILESCCn1ncc(S(=O)(=O)Nc2cccnc2)c1C
InChIInChI=1S/C11H14N4O2S/c1-3-15-9(2)11(8-13-15)18(16,17)14-10-5-4-6-12-7-10/h4-8,14H,3H2,1-2H3
InChIKeyUAQODIPXMZKAJH-UHFFFAOYSA-N
XLogP1.41
TPSA76.88 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.33
LogP ≤ 51.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 1-ethyl-5-methyl-N-pyridin-3-ylpyrazole-4-sulfonamide?
The IUPAC name of 1-ethyl-5-methyl-N-pyridin-3-ylpyrazole-4-sulfonamide (CID 6470411) is 1-ethyl-5-methyl-N-pyridin-3-ylpyrazole-4-sulfonamide.
What is the SMILES notation for 1-ethyl-5-methyl-N-pyridin-3-ylpyrazole-4-sulfonamide?
The canonical SMILES for 1-ethyl-5-methyl-N-pyridin-3-ylpyrazole-4-sulfonamide is CCn1ncc(S(=O)(=O)Nc2cccnc2)c1C.
What is the InChIKey of 1-ethyl-5-methyl-N-pyridin-3-ylpyrazole-4-sulfonamide?
The InChIKey is UAQODIPXMZKAJH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N4O2S/c1-3-15-9(2)11(8-13-15)18(16,17)14-10-5-4-6-12-7-10/h4-8,14H,3H2,1-2H3.
What are the key properties of 1-ethyl-5-methyl-N-pyridin-3-ylpyrazole-4-sulfonamide?
1-ethyl-5-methyl-N-pyridin-3-ylpyrazole-4-sulfonamide has a molecular weight of 266.33 g/mol, XLogP of 1.41, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-5-methyl-N-pyridin-3-ylpyrazole-4-sulfonamide is sourced from PubChem (CID 6470411), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).