1-cyclopropyl-N-(5-ethyl-1H-pyrazol-3-yl)methanesulfonamide

C9H15N3O2S — CID 104620660

IUPAC1-cyclopropyl-N-(5-ethyl-1H-pyrazol-3-yl)methanesulfonamide
SMILESCCc1cc(NS(=O)(=O)CC2CC2)n[nH]1
InChIInChI=1S/C9H15N3O2S/c1-2-8-5-9(11-10-8)12-15(13,14)6-7-3-4-7/h5,7H,2-4,6H2,1H3,(H2,10,11,12)
InChIKeyKGHBNIGHHYTJJT-UHFFFAOYSA-N
MW229.30 g/mol
LogP1.12
Rot. Bonds5

About 1-cyclopropyl-N-(5-ethyl-1H-pyrazol-3-yl)methanesulfonamide

1-cyclopropyl-N-(5-ethyl-1H-pyrazol-3-yl)methanesulfonamide (PubChem CID 104620660) has the molecular formula C9H15N3O2S and a molecular weight of 229.30 g/mol. Its IUPAC name is 1-cyclopropyl-N-(5-ethyl-1H-pyrazol-3-yl)methanesulfonamide.

Molecular Properties

Compound Name1-cyclopropyl-N-(5-ethyl-1H-pyrazol-3-yl)methanesulfonamide
PubChem CID104620660
Molecular FormulaC9H15N3O2S
Molecular Weight229.30 g/mol
Exact Mass229.09
IUPAC Name1-cyclopropyl-N-(5-ethyl-1H-pyrazol-3-yl)methanesulfonamide
SMILESCCc1cc(NS(=O)(=O)CC2CC2)n[nH]1
InChIInChI=1S/C9H15N3O2S/c1-2-8-5-9(11-10-8)12-15(13,14)6-7-3-4-7/h5,7H,2-4,6H2,1H3,(H2,10,11,12)
InChIKeyKGHBNIGHHYTJJT-UHFFFAOYSA-N
XLogP1.12
TPSA74.85 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.30
LogP ≤ 51.12
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-cyclopropyl-N-(5-ethyl-1H-pyrazol-3-yl)methanesulfonamide?
The IUPAC name of 1-cyclopropyl-N-(5-ethyl-1H-pyrazol-3-yl)methanesulfonamide (CID 104620660) is 1-cyclopropyl-N-(5-ethyl-1H-pyrazol-3-yl)methanesulfonamide.
What is the SMILES notation for 1-cyclopropyl-N-(5-ethyl-1H-pyrazol-3-yl)methanesulfonamide?
The canonical SMILES for 1-cyclopropyl-N-(5-ethyl-1H-pyrazol-3-yl)methanesulfonamide is CCc1cc(NS(=O)(=O)CC2CC2)n[nH]1.
What is the InChIKey of 1-cyclopropyl-N-(5-ethyl-1H-pyrazol-3-yl)methanesulfonamide?
The InChIKey is KGHBNIGHHYTJJT-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15N3O2S/c1-2-8-5-9(11-10-8)12-15(13,14)6-7-3-4-7/h5,7H,2-4,6H2,1H3,(H2,10,11,12).
What are the key properties of 1-cyclopropyl-N-(5-ethyl-1H-pyrazol-3-yl)methanesulfonamide?
1-cyclopropyl-N-(5-ethyl-1H-pyrazol-3-yl)methanesulfonamide has a molecular weight of 229.30 g/mol, XLogP of 1.12, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropyl-N-(5-ethyl-1H-pyrazol-3-yl)methanesulfonamide is sourced from PubChem (CID 104620660), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).