3-(hydroxymethyl)-N-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]piperidine-1-sulfonamide

C10H18N4O4S — CID 106410338

IUPAC3-(hydroxymethyl)-N-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]piperidine-1-sulfonamide
SMILESCc1nc(CNS(=O)(=O)N2CCCC(CO)C2)no1
InChIInChI=1S/C10H18N4O4S/c1-8-12-10(13-18-8)5-11-19(16,17)14-4-2-3-9(6-14)7-15/h9,11,15H,2-7H2,1H3
InChIKeyXQZYNWZJKQRPJH-UHFFFAOYSA-N
MW290.34 g/mol
LogP-0.58
Rot. Bonds5

About 3-(hydroxymethyl)-N-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]piperidine-1-sulfonamide

3-(hydroxymethyl)-N-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]piperidine-1-sulfonamide (PubChem CID 106410338) has the molecular formula C10H18N4O4S and a molecular weight of 290.34 g/mol. Its IUPAC name is 3-(hydroxymethyl)-N-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]piperidine-1-sulfonamide.

Molecular Properties

Compound Name3-(hydroxymethyl)-N-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]piperidine-1-sulfonamide
PubChem CID106410338
Molecular FormulaC10H18N4O4S
Molecular Weight290.34 g/mol
Exact Mass290.10
IUPAC Name3-(hydroxymethyl)-N-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]piperidine-1-sulfonamide
SMILESCc1nc(CNS(=O)(=O)N2CCCC(CO)C2)no1
InChIInChI=1S/C10H18N4O4S/c1-8-12-10(13-18-8)5-11-19(16,17)14-4-2-3-9(6-14)7-15/h9,11,15H,2-7H2,1H3
InChIKeyXQZYNWZJKQRPJH-UHFFFAOYSA-N
XLogP-0.58
TPSA108.56 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.34
LogP ≤ 5-0.58
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

3-(hydroxymethyl)-N-[2-(5-methyl-1,2,4-oxadiazol-3-yl)ethyl]piperidine-1-sulfonamide
CID 106423465
2-(5-methyl-1,2,4-oxadiazol-3-yl)-N-[(1-methylsulfonylpiperidin-3-yl)methyl]ethanamine
CID 103746439
[1-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonyl]piperidin-3-yl]methanol
CID 5185428
N-[2-[ethyl(methyl)amino]ethyl]-3-(hydroxymethyl)piperidine-1-sulfonamide
CID 114134691
(2R)-N,N-dimethyl-2-[(3R)-3-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]piperidin-1-yl]sulfonylpropanamide
CID 124829296
4-(methylaminomethyl)-N-[2-(5-methyl-1,2,4-oxadiazol-3-yl)ethyl]piperidine-1-sulfonamide
CID 106423659
2-(5-methyl-1,2,4-oxadiazol-3-yl)-N-[(1-methylpiperidin-3-yl)methyl]ethanamine
CID 114185670
3-(methylaminomethyl)-N-[(1-methyl-1,2,4-triazol-3-yl)methyl]piperidine-1-sulfonamide
CID 106093569
N-[2-[ethyl(propyl)amino]ethyl]-3-(hydroxymethyl)piperidine-1-sulfonamide
CID 106014030
(3R)-N-[(2S)-2-cyanopropyl]-N-methyl-3-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]piperidine-1-sulfonamide
CID 124875045
3-(methoxymethyl)-N-[(3-propyl-1,2-oxazol-5-yl)methyl]piperidine-1-sulfonamide
CID 131901449
3-(methylaminomethyl)-N-[(6-methyl-2-pyridinyl)methyl]piperidine-1-sulfonamide
CID 106055017

Frequently Asked Questions

What is the IUPAC name of 3-(hydroxymethyl)-N-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]piperidine-1-sulfonamide?
The IUPAC name of 3-(hydroxymethyl)-N-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]piperidine-1-sulfonamide (CID 106410338) is 3-(hydroxymethyl)-N-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]piperidine-1-sulfonamide.
What is the SMILES notation for 3-(hydroxymethyl)-N-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]piperidine-1-sulfonamide?
The canonical SMILES for 3-(hydroxymethyl)-N-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]piperidine-1-sulfonamide is Cc1nc(CNS(=O)(=O)N2CCCC(CO)C2)no1.
What is the InChIKey of 3-(hydroxymethyl)-N-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]piperidine-1-sulfonamide?
The InChIKey is XQZYNWZJKQRPJH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N4O4S/c1-8-12-10(13-18-8)5-11-19(16,17)14-4-2-3-9(6-14)7-15/h9,11,15H,2-7H2,1H3.
What are the key properties of 3-(hydroxymethyl)-N-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]piperidine-1-sulfonamide?
3-(hydroxymethyl)-N-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]piperidine-1-sulfonamide has a molecular weight of 290.34 g/mol, XLogP of -0.58, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(hydroxymethyl)-N-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]piperidine-1-sulfonamide is sourced from PubChem (CID 106410338), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).