N'-(1,3,5-trimethylpyrazol-4-yl)sulfonylcyclopropanecarbohydrazide

C10H16N4O3S — CID 8822921

IUPACN'-(1,3,5-trimethylpyrazol-4-yl)sulfonylcyclopropanecarbohydrazide
SMILESCc1nn(C)c(C)c1S(=O)(=O)NNC(=O)C1CC1
InChIInChI=1S/C10H16N4O3S/c1-6-9(7(2)14(3)12-6)18(16,17)13-11-10(15)8-4-5-8/h8,13H,4-5H2,1-3H3,(H,11,15)
InChIKeyQLGOGTMKKVJNJL-UHFFFAOYSA-N
MW272.33 g/mol
LogP-0.24
Rot. Bonds4

About N'-(1,3,5-trimethylpyrazol-4-yl)sulfonylcyclopropanecarbohydrazide

N'-(1,3,5-trimethylpyrazol-4-yl)sulfonylcyclopropanecarbohydrazide (PubChem CID 8822921) has the molecular formula C10H16N4O3S and a molecular weight of 272.33 g/mol. Its IUPAC name is N'-(1,3,5-trimethylpyrazol-4-yl)sulfonylcyclopropanecarbohydrazide.

Molecular Properties

Compound NameN'-(1,3,5-trimethylpyrazol-4-yl)sulfonylcyclopropanecarbohydrazide
PubChem CID8822921
Molecular FormulaC10H16N4O3S
Molecular Weight272.33 g/mol
Exact Mass272.09
IUPAC NameN'-(1,3,5-trimethylpyrazol-4-yl)sulfonylcyclopropanecarbohydrazide
SMILESCc1nn(C)c(C)c1S(=O)(=O)NNC(=O)C1CC1
InChIInChI=1S/C10H16N4O3S/c1-6-9(7(2)14(3)12-6)18(16,17)13-11-10(15)8-4-5-8/h8,13H,4-5H2,1-3H3,(H,11,15)
InChIKeyQLGOGTMKKVJNJL-UHFFFAOYSA-N
XLogP-0.24
TPSA93.09 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.33
LogP ≤ 5-0.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N'-(1,3,5-trimethylpyrazol-4-yl)sulfonylcyclopropanecarbohydrazide?
The IUPAC name of N'-(1,3,5-trimethylpyrazol-4-yl)sulfonylcyclopropanecarbohydrazide (CID 8822921) is N'-(1,3,5-trimethylpyrazol-4-yl)sulfonylcyclopropanecarbohydrazide.
What is the SMILES notation for N'-(1,3,5-trimethylpyrazol-4-yl)sulfonylcyclopropanecarbohydrazide?
The canonical SMILES for N'-(1,3,5-trimethylpyrazol-4-yl)sulfonylcyclopropanecarbohydrazide is Cc1nn(C)c(C)c1S(=O)(=O)NNC(=O)C1CC1.
What is the InChIKey of N'-(1,3,5-trimethylpyrazol-4-yl)sulfonylcyclopropanecarbohydrazide?
The InChIKey is QLGOGTMKKVJNJL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N4O3S/c1-6-9(7(2)14(3)12-6)18(16,17)13-11-10(15)8-4-5-8/h8,13H,4-5H2,1-3H3,(H,11,15).
What are the key properties of N'-(1,3,5-trimethylpyrazol-4-yl)sulfonylcyclopropanecarbohydrazide?
N'-(1,3,5-trimethylpyrazol-4-yl)sulfonylcyclopropanecarbohydrazide has a molecular weight of 272.33 g/mol, XLogP of -0.24, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(1,3,5-trimethylpyrazol-4-yl)sulfonylcyclopropanecarbohydrazide is sourced from PubChem (CID 8822921), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).