1-ethylsulfonyl-N-(1H-pyrazol-4-yl)piperidine-4-carboxamide

C11H18N4O3S — CID 43430748

IUPAC1-ethylsulfonyl-N-(1H-pyrazol-4-yl)piperidine-4-carboxamide
SMILESCCS(=O)(=O)N1CCC(C(=O)Nc2cn[nH]c2)CC1
InChIInChI=1S/C11H18N4O3S/c1-2-19(17,18)15-5-3-9(4-6-15)11(16)14-10-7-12-13-8-10/h7-9H,2-6H2,1H3,(H,12,13)(H,14,16)
InChIKeyHFYRAPQAXCUJEA-UHFFFAOYSA-N
MW286.36 g/mol
LogP0.41
Rot. Bonds4

About 1-ethylsulfonyl-N-(1H-pyrazol-4-yl)piperidine-4-carboxamide

1-ethylsulfonyl-N-(1H-pyrazol-4-yl)piperidine-4-carboxamide (PubChem CID 43430748) has the molecular formula C11H18N4O3S and a molecular weight of 286.36 g/mol. Its IUPAC name is 1-ethylsulfonyl-N-(1H-pyrazol-4-yl)piperidine-4-carboxamide.

Molecular Properties

Compound Name1-ethylsulfonyl-N-(1H-pyrazol-4-yl)piperidine-4-carboxamide
PubChem CID43430748
Molecular FormulaC11H18N4O3S
Molecular Weight286.36 g/mol
Exact Mass286.11
IUPAC Name1-ethylsulfonyl-N-(1H-pyrazol-4-yl)piperidine-4-carboxamide
SMILESCCS(=O)(=O)N1CCC(C(=O)Nc2cn[nH]c2)CC1
InChIInChI=1S/C11H18N4O3S/c1-2-19(17,18)15-5-3-9(4-6-15)11(16)14-10-7-12-13-8-10/h7-9H,2-6H2,1H3,(H,12,13)(H,14,16)
InChIKeyHFYRAPQAXCUJEA-UHFFFAOYSA-N
XLogP0.41
TPSA95.16 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.36
LogP ≤ 50.41
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 1-ethylsulfonyl-N-(1H-pyrazol-4-yl)piperidine-4-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 1-ethylsulfonyl-N-(1H-pyrazol-4-yl)piperidine-4-carboxamide?
The IUPAC name of 1-ethylsulfonyl-N-(1H-pyrazol-4-yl)piperidine-4-carboxamide (CID 43430748) is 1-ethylsulfonyl-N-(1H-pyrazol-4-yl)piperidine-4-carboxamide.
What is the SMILES notation for 1-ethylsulfonyl-N-(1H-pyrazol-4-yl)piperidine-4-carboxamide?
The canonical SMILES for 1-ethylsulfonyl-N-(1H-pyrazol-4-yl)piperidine-4-carboxamide is CCS(=O)(=O)N1CCC(C(=O)Nc2cn[nH]c2)CC1.
What is the InChIKey of 1-ethylsulfonyl-N-(1H-pyrazol-4-yl)piperidine-4-carboxamide?
The InChIKey is HFYRAPQAXCUJEA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N4O3S/c1-2-19(17,18)15-5-3-9(4-6-15)11(16)14-10-7-12-13-8-10/h7-9H,2-6H2,1H3,(H,12,13)(H,14,16).
What are the key properties of 1-ethylsulfonyl-N-(1H-pyrazol-4-yl)piperidine-4-carboxamide?
1-ethylsulfonyl-N-(1H-pyrazol-4-yl)piperidine-4-carboxamide has a molecular weight of 286.36 g/mol, XLogP of 0.41, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethylsulfonyl-N-(1H-pyrazol-4-yl)piperidine-4-carboxamide is sourced from PubChem (CID 43430748), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).