4-methylsulfonylpiperidine-1-carboxamide

C7H14N2O3S — CID 130659169

IUPAC4-methylsulfonylpiperidine-1-carboxamide
SMILESCS(=O)(=O)C1CCN(C(N)=O)CC1
InChIInChI=1S/C7H14N2O3S/c1-13(11,12)6-2-4-9(5-3-6)7(8)10/h6H,2-5H2,1H3,(H2,8,10)
InChIKeyZZTWPVYNSQOWEC-UHFFFAOYSA-N
MW206.27 g/mol
LogP-0.43
Rot. Bonds1

About 4-methylsulfonylpiperidine-1-carboxamide

4-methylsulfonylpiperidine-1-carboxamide (PubChem CID 130659169) has the molecular formula C7H14N2O3S and a molecular weight of 206.27 g/mol. Its IUPAC name is 4-methylsulfonylpiperidine-1-carboxamide.

Molecular Properties

Compound Name4-methylsulfonylpiperidine-1-carboxamide
PubChem CID130659169
Molecular FormulaC7H14N2O3S
Molecular Weight206.27 g/mol
Exact Mass206.07
IUPAC Name4-methylsulfonylpiperidine-1-carboxamide
SMILESCS(=O)(=O)C1CCN(C(N)=O)CC1
InChIInChI=1S/C7H14N2O3S/c1-13(11,12)6-2-4-9(5-3-6)7(8)10/h6H,2-5H2,1H3,(H2,8,10)
InChIKeyZZTWPVYNSQOWEC-UHFFFAOYSA-N
XLogP-0.43
TPSA80.47 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.27
LogP ≤ 5-0.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-methylsulfonylpiperidine-1-carbonyl chloride
CID 130652267
N'-methyl-4-methylsulfonylpiperidine-1-carboximidamide
CID 89374676
4-(methylamino)piperidine-1-carboxamide
CID 43754889
4-methylsulfonyl-N-pentan-3-ylpiperidine-1-carboxamide
CID 90585273
4-sulfanylpiperidine-1-carboxamide
CID 165469353
5-(4-methylsulfonylpiperidine-1-carbonyl)pyrrolidin-2-one
CID 90586478
1-cyclopropylsulfonyl-4-methylsulfonylpiperidine
CID 71805701
(4-methylsulfonylpiperidin-1-yl)-(4-propylthiadiazol-5-yl)methanone
CID 71805668
1-(1-carbamoylpiperidin-4-yl)ethyl acetate
CID 174509053
4-(4-methylsulfonylphenoxy)piperidine-1-carboxamide
CID 71166636
3-methylsulfonylpyrrolidine-1-sulfonamide
CID 57434350
2-cyclohexyl-1-(3-methylsulfonylpyrrolidin-1-yl)ethanone
CID 90584553

Frequently Asked Questions

What is the IUPAC name of 4-methylsulfonylpiperidine-1-carboxamide?
The IUPAC name of 4-methylsulfonylpiperidine-1-carboxamide (CID 130659169) is 4-methylsulfonylpiperidine-1-carboxamide.
What is the SMILES notation for 4-methylsulfonylpiperidine-1-carboxamide?
The canonical SMILES for 4-methylsulfonylpiperidine-1-carboxamide is CS(=O)(=O)C1CCN(C(N)=O)CC1.
What is the InChIKey of 4-methylsulfonylpiperidine-1-carboxamide?
The InChIKey is ZZTWPVYNSQOWEC-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H14N2O3S/c1-13(11,12)6-2-4-9(5-3-6)7(8)10/h6H,2-5H2,1H3,(H2,8,10).
What are the key properties of 4-methylsulfonylpiperidine-1-carboxamide?
4-methylsulfonylpiperidine-1-carboxamide has a molecular weight of 206.27 g/mol, XLogP of -0.43, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methylsulfonylpiperidine-1-carboxamide is sourced from PubChem (CID 130659169), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).