N-(1-methylpyrazol-3-yl)-1-methylsulfonylpiperidine-4-carboxamide

C11H18N4O3S — CID 19581952

IUPACN-(1-methylpyrazol-3-yl)-1-methylsulfonylpiperidine-4-carboxamide
SMILESCn1ccc(NC(=O)C2CCN(S(C)(=O)=O)CC2)n1
InChIInChI=1S/C11H18N4O3S/c1-14-6-5-10(13-14)12-11(16)9-3-7-15(8-4-9)19(2,17)18/h5-6,9H,3-4,7-8H2,1-2H3,(H,12,13,16)
InChIKeyZOYMZEALVWRXLO-UHFFFAOYSA-N
MW286.36 g/mol
LogP0.03
Rot. Bonds3

About N-(1-methylpyrazol-3-yl)-1-methylsulfonylpiperidine-4-carboxamide

N-(1-methylpyrazol-3-yl)-1-methylsulfonylpiperidine-4-carboxamide (PubChem CID 19581952) has the molecular formula C11H18N4O3S and a molecular weight of 286.36 g/mol. Its IUPAC name is N-(1-methylpyrazol-3-yl)-1-methylsulfonylpiperidine-4-carboxamide.

Molecular Properties

Compound NameN-(1-methylpyrazol-3-yl)-1-methylsulfonylpiperidine-4-carboxamide
PubChem CID19581952
Molecular FormulaC11H18N4O3S
Molecular Weight286.36 g/mol
Exact Mass286.11
IUPAC NameN-(1-methylpyrazol-3-yl)-1-methylsulfonylpiperidine-4-carboxamide
SMILESCn1ccc(NC(=O)C2CCN(S(C)(=O)=O)CC2)n1
InChIInChI=1S/C11H18N4O3S/c1-14-6-5-10(13-14)12-11(16)9-3-7-15(8-4-9)19(2,17)18/h5-6,9H,3-4,7-8H2,1-2H3,(H,12,13,16)
InChIKeyZOYMZEALVWRXLO-UHFFFAOYSA-N
XLogP0.03
TPSA84.30 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.36
LogP ≤ 50.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze N-(1-methylpyrazol-3-yl)-1-methylsulfonylpiperidine-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 N-(1-methylpyrazol-3-yl)-1-methylsulfonylpiperidine-4-carboxamide?
The IUPAC name of N-(1-methylpyrazol-3-yl)-1-methylsulfonylpiperidine-4-carboxamide (CID 19581952) is N-(1-methylpyrazol-3-yl)-1-methylsulfonylpiperidine-4-carboxamide.
What is the SMILES notation for N-(1-methylpyrazol-3-yl)-1-methylsulfonylpiperidine-4-carboxamide?
The canonical SMILES for N-(1-methylpyrazol-3-yl)-1-methylsulfonylpiperidine-4-carboxamide is Cn1ccc(NC(=O)C2CCN(S(C)(=O)=O)CC2)n1.
What is the InChIKey of N-(1-methylpyrazol-3-yl)-1-methylsulfonylpiperidine-4-carboxamide?
The InChIKey is ZOYMZEALVWRXLO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N4O3S/c1-14-6-5-10(13-14)12-11(16)9-3-7-15(8-4-9)19(2,17)18/h5-6,9H,3-4,7-8H2,1-2H3,(H,12,13,16).
What are the key properties of N-(1-methylpyrazol-3-yl)-1-methylsulfonylpiperidine-4-carboxamide?
N-(1-methylpyrazol-3-yl)-1-methylsulfonylpiperidine-4-carboxamide has a molecular weight of 286.36 g/mol, XLogP of 0.03, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-methylpyrazol-3-yl)-1-methylsulfonylpiperidine-4-carboxamide is sourced from PubChem (CID 19581952), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).