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3-amino-1-ethyl-N-(3-hydroxyphenyl)pyrazole-4-sulfonamide

C11H14N4O3S — CID 61167291

Data last refreshed: (MolForge compound catalog, from PubChem)

IUPAC3-amino-1-ethyl-N-(3-hydroxyphenyl)pyrazole-4-sulfonamide
SMILESCCn1cc(S(=O)(=O)Nc2cccc(O)c2)c(N)n1
InChIInChI=1S/C11H14N4O3S/c1-2-15-7-10(11(12)13-15)19(17,18)14-8-4-3-5-9(16)6-8/h3-7,14,16H,2H2,1H3,(H2,12,13)
InChIKeyUZHOYCDZIVVFKO-UHFFFAOYSA-N
MW282.32 g/mol
LogP0.99
Rot. Bonds4

About 3-amino-1-ethyl-N-(3-hydroxyphenyl)pyrazole-4-sulfonamide

3-amino-1-ethyl-N-(3-hydroxyphenyl)pyrazole-4-sulfonamide (PubChem CID 61167291) has the molecular formula C11H14N4O3S and a molecular weight of 282.32 g/mol. Its IUPAC name is 3-amino-1-ethyl-N-(3-hydroxyphenyl)pyrazole-4-sulfonamide.

Molecular Properties

Compound Name3-amino-1-ethyl-N-(3-hydroxyphenyl)pyrazole-4-sulfonamide
PubChem CID61167291
Molecular FormulaC11H14N4O3S
Molecular Weight282.32 g/mol
Exact Mass282.08
IUPAC Name3-amino-1-ethyl-N-(3-hydroxyphenyl)pyrazole-4-sulfonamide
SMILESCCn1cc(S(=O)(=O)Nc2cccc(O)c2)c(N)n1
InChIInChI=1S/C11H14N4O3S/c1-2-15-7-10(11(12)13-15)19(17,18)14-8-4-3-5-9(16)6-8/h3-7,14,16H,2H2,1H3,(H2,12,13)
InChIKeyUZHOYCDZIVVFKO-UHFFFAOYSA-N
XLogP0.99
TPSA110.24 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.32
LogP ≤ 50.99
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 3-amino-1-ethyl-N-(3-hydroxyphenyl)pyrazole-4-sulfonamide?
The IUPAC name of 3-amino-1-ethyl-N-(3-hydroxyphenyl)pyrazole-4-sulfonamide (CID 61167291) is 3-amino-1-ethyl-N-(3-hydroxyphenyl)pyrazole-4-sulfonamide.
What is the SMILES notation for 3-amino-1-ethyl-N-(3-hydroxyphenyl)pyrazole-4-sulfonamide?
The canonical SMILES for 3-amino-1-ethyl-N-(3-hydroxyphenyl)pyrazole-4-sulfonamide is CCn1cc(S(=O)(=O)Nc2cccc(O)c2)c(N)n1.
What is the InChIKey of 3-amino-1-ethyl-N-(3-hydroxyphenyl)pyrazole-4-sulfonamide?
The InChIKey is UZHOYCDZIVVFKO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N4O3S/c1-2-15-7-10(11(12)13-15)19(17,18)14-8-4-3-5-9(16)6-8/h3-7,14,16H,2H2,1H3,(H2,12,13).
What are the key properties of 3-amino-1-ethyl-N-(3-hydroxyphenyl)pyrazole-4-sulfonamide?
3-amino-1-ethyl-N-(3-hydroxyphenyl)pyrazole-4-sulfonamide has a molecular weight of 282.32 g/mol, XLogP of 0.99, 4 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-1-ethyl-N-(3-hydroxyphenyl)pyrazole-4-sulfonamide is sourced from PubChem (CID 61167291), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).

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