3-(methoxymethyl)-N-[(3-propyl-1,2-oxazol-5-yl)methyl]piperidine-1-sulfonamide

C14H25N3O4S — CID 131901449

IUPAC3-(methoxymethyl)-N-[(3-propyl-1,2-oxazol-5-yl)methyl]piperidine-1-sulfonamide
SMILESCCCc1cc(CNS(=O)(=O)N2CCCC(COC)C2)on1
InChIInChI=1S/C14H25N3O4S/c1-3-5-13-8-14(21-16-13)9-15-22(18,19)17-7-4-6-12(10-17)11-20-2/h8,12,15H,3-7,9-11H2,1-2H3
InChIKeyPITSKGFRHLNOOK-UHFFFAOYSA-N
MW331.44 g/mol
LogP1.32
Rot. Bonds8

About 3-(methoxymethyl)-N-[(3-propyl-1,2-oxazol-5-yl)methyl]piperidine-1-sulfonamide

3-(methoxymethyl)-N-[(3-propyl-1,2-oxazol-5-yl)methyl]piperidine-1-sulfonamide (PubChem CID 131901449) has the molecular formula C14H25N3O4S and a molecular weight of 331.44 g/mol. Its IUPAC name is 3-(methoxymethyl)-N-[(3-propyl-1,2-oxazol-5-yl)methyl]piperidine-1-sulfonamide.

Molecular Properties

Compound Name3-(methoxymethyl)-N-[(3-propyl-1,2-oxazol-5-yl)methyl]piperidine-1-sulfonamide
PubChem CID131901449
Molecular FormulaC14H25N3O4S
Molecular Weight331.44 g/mol
Exact Mass331.16
IUPAC Name3-(methoxymethyl)-N-[(3-propyl-1,2-oxazol-5-yl)methyl]piperidine-1-sulfonamide
SMILESCCCc1cc(CNS(=O)(=O)N2CCCC(COC)C2)on1
InChIInChI=1S/C14H25N3O4S/c1-3-5-13-8-14(21-16-13)9-15-22(18,19)17-7-4-6-12(10-17)11-20-2/h8,12,15H,3-7,9-11H2,1-2H3
InChIKeyPITSKGFRHLNOOK-UHFFFAOYSA-N
XLogP1.32
TPSA84.67 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500331.44
LogP ≤ 51.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

3-(methoxymethyl)-N-[(2-methyl-1,3-thiazol-4-yl)methyl]piperidine-1-sulfonamide
CID 131931237
N-[(2-imidazol-1-ylphenyl)methyl]-3-(methoxymethyl)piperidine-1-sulfonamide
CID 131948153
3-(ethoxymethyl)-N-ethylpiperidine-1-sulfonamide
CID 110610365
(3R)-3-methyl-N-[(3-phenyl-1,2-oxazol-5-yl)methyl]piperidine-1-sulfonamide
CID 94064692
3-(ethylaminomethyl)-N-(1H-pyrazol-4-ylmethyl)piperidine-1-sulfonamide
CID 106016068
3-[(cyclopropylamino)methyl]-N-(1,2-oxazol-5-ylmethyl)piperidine-1-sulfonamide
CID 106424009
N-ethyl-4-[3-(methoxymethyl)piperidin-1-yl]sulfonylaniline
CID 106588733
[4-[3-(methoxymethyl)piperidin-1-yl]sulfonyl-5-methylfuran-2-yl]methanamine
CID 106590010
3-(hydroxymethyl)-N-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]piperidine-1-sulfonamide
CID 106410338
1-cyclopropylsulfonyl-3-(methoxymethyl)piperidine
CID 121092342
N-[[5-[3-(methoxymethyl)piperidin-1-yl]sulfonyl-1H-pyrazol-4-yl]methyl]ethanamine
CID 106590018
N-ethyl-3-[3-(methoxymethyl)piperidin-1-yl]sulfonylpyridin-2-amine
CID 106588741

Frequently Asked Questions

What is the IUPAC name of 3-(methoxymethyl)-N-[(3-propyl-1,2-oxazol-5-yl)methyl]piperidine-1-sulfonamide?
The IUPAC name of 3-(methoxymethyl)-N-[(3-propyl-1,2-oxazol-5-yl)methyl]piperidine-1-sulfonamide (CID 131901449) is 3-(methoxymethyl)-N-[(3-propyl-1,2-oxazol-5-yl)methyl]piperidine-1-sulfonamide.
What is the SMILES notation for 3-(methoxymethyl)-N-[(3-propyl-1,2-oxazol-5-yl)methyl]piperidine-1-sulfonamide?
The canonical SMILES for 3-(methoxymethyl)-N-[(3-propyl-1,2-oxazol-5-yl)methyl]piperidine-1-sulfonamide is CCCc1cc(CNS(=O)(=O)N2CCCC(COC)C2)on1.
What is the InChIKey of 3-(methoxymethyl)-N-[(3-propyl-1,2-oxazol-5-yl)methyl]piperidine-1-sulfonamide?
The InChIKey is PITSKGFRHLNOOK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25N3O4S/c1-3-5-13-8-14(21-16-13)9-15-22(18,19)17-7-4-6-12(10-17)11-20-2/h8,12,15H,3-7,9-11H2,1-2H3.
What are the key properties of 3-(methoxymethyl)-N-[(3-propyl-1,2-oxazol-5-yl)methyl]piperidine-1-sulfonamide?
3-(methoxymethyl)-N-[(3-propyl-1,2-oxazol-5-yl)methyl]piperidine-1-sulfonamide has a molecular weight of 331.44 g/mol, XLogP of 1.32, 8 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(methoxymethyl)-N-[(3-propyl-1,2-oxazol-5-yl)methyl]piperidine-1-sulfonamide is sourced from PubChem (CID 131901449), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).