6-(4-amino-3,5-diethylpyrazol-1-yl)pyridine-3-sulfonamide

C12H17N5O2S — CID 82703257

IUPAC6-(4-amino-3,5-diethylpyrazol-1-yl)pyridine-3-sulfonamide
SMILESCCc1nn(-c2ccc(S(N)(=O)=O)cn2)c(CC)c1N
InChIInChI=1S/C12H17N5O2S/c1-3-9-12(13)10(4-2)17(16-9)11-6-5-8(7-15-11)20(14,18)19/h5-7H,3-4,13H2,1-2H3,(H2,14,18,19)
InChIKeyIUAQNVYTDLAMLD-UHFFFAOYSA-N
MW295.37 g/mol
LogP0.62
Rot. Bonds4

About 6-(4-amino-3,5-diethylpyrazol-1-yl)pyridine-3-sulfonamide

6-(4-amino-3,5-diethylpyrazol-1-yl)pyridine-3-sulfonamide (PubChem CID 82703257) has the molecular formula C12H17N5O2S and a molecular weight of 295.37 g/mol. Its IUPAC name is 6-(4-amino-3,5-diethylpyrazol-1-yl)pyridine-3-sulfonamide.

Molecular Properties

Compound Name6-(4-amino-3,5-diethylpyrazol-1-yl)pyridine-3-sulfonamide
PubChem CID82703257
Molecular FormulaC12H17N5O2S
Molecular Weight295.37 g/mol
Exact Mass295.11
IUPAC Name6-(4-amino-3,5-diethylpyrazol-1-yl)pyridine-3-sulfonamide
SMILESCCc1nn(-c2ccc(S(N)(=O)=O)cn2)c(CC)c1N
InChIInChI=1S/C12H17N5O2S/c1-3-9-12(13)10(4-2)17(16-9)11-6-5-8(7-15-11)20(14,18)19/h5-7H,3-4,13H2,1-2H3,(H2,14,18,19)
InChIKeyIUAQNVYTDLAMLD-UHFFFAOYSA-N
XLogP0.62
TPSA116.89 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.37
LogP ≤ 50.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 6-(4-amino-3,5-diethylpyrazol-1-yl)pyridine-3-sulfonamide?
The IUPAC name of 6-(4-amino-3,5-diethylpyrazol-1-yl)pyridine-3-sulfonamide (CID 82703257) is 6-(4-amino-3,5-diethylpyrazol-1-yl)pyridine-3-sulfonamide.
What is the SMILES notation for 6-(4-amino-3,5-diethylpyrazol-1-yl)pyridine-3-sulfonamide?
The canonical SMILES for 6-(4-amino-3,5-diethylpyrazol-1-yl)pyridine-3-sulfonamide is CCc1nn(-c2ccc(S(N)(=O)=O)cn2)c(CC)c1N.
What is the InChIKey of 6-(4-amino-3,5-diethylpyrazol-1-yl)pyridine-3-sulfonamide?
The InChIKey is IUAQNVYTDLAMLD-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17N5O2S/c1-3-9-12(13)10(4-2)17(16-9)11-6-5-8(7-15-11)20(14,18)19/h5-7H,3-4,13H2,1-2H3,(H2,14,18,19).
What are the key properties of 6-(4-amino-3,5-diethylpyrazol-1-yl)pyridine-3-sulfonamide?
6-(4-amino-3,5-diethylpyrazol-1-yl)pyridine-3-sulfonamide has a molecular weight of 295.37 g/mol, XLogP of 0.62, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(4-amino-3,5-diethylpyrazol-1-yl)pyridine-3-sulfonamide is sourced from PubChem (CID 82703257), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).