2-methyl-5-[(4-methylpiperidin-3-yl)oxymethyl]-1,3,4-oxadiazole

C10H17N3O2 — CID 102954373

IUPAC2-methyl-5-[(4-methylpiperidin-3-yl)oxymethyl]-1,3,4-oxadiazole
SMILESCc1nnc(COC2CNCCC2C)o1
InChIInChI=1S/C10H17N3O2/c1-7-3-4-11-5-9(7)14-6-10-13-12-8(2)15-10/h7,9,11H,3-6H2,1-2H3
InChIKeyIUGJWSHFFRZXGO-UHFFFAOYSA-N
MW211.26 g/mol
LogP0.89
Rot. Bonds3

About 2-methyl-5-[(4-methylpiperidin-3-yl)oxymethyl]-1,3,4-oxadiazole

2-methyl-5-[(4-methylpiperidin-3-yl)oxymethyl]-1,3,4-oxadiazole (PubChem CID 102954373) has the molecular formula C10H17N3O2 and a molecular weight of 211.26 g/mol. Its IUPAC name is 2-methyl-5-[(4-methylpiperidin-3-yl)oxymethyl]-1,3,4-oxadiazole.

Molecular Properties

Compound Name2-methyl-5-[(4-methylpiperidin-3-yl)oxymethyl]-1,3,4-oxadiazole
PubChem CID102954373
Molecular FormulaC10H17N3O2
Molecular Weight211.26 g/mol
Exact Mass211.13
IUPAC Name2-methyl-5-[(4-methylpiperidin-3-yl)oxymethyl]-1,3,4-oxadiazole
SMILESCc1nnc(COC2CNCCC2C)o1
InChIInChI=1S/C10H17N3O2/c1-7-3-4-11-5-9(7)14-6-10-13-12-8(2)15-10/h7,9,11H,3-6H2,1-2H3
InChIKeyIUGJWSHFFRZXGO-UHFFFAOYSA-N
XLogP0.89
TPSA60.18 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.26
LogP ≤ 50.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

3-cyclopropyl-5-[(4-methylpiperidin-3-yl)oxymethyl]-1,2,4-oxadiazole
CID 102954079
4-[(4-methylpiperidin-3-yl)oxymethyl]pyridine
CID 102954056
3-methyl-5-[(4-methylpiperidin-3-yl)oxymethyl]pyridine
CID 102954306
4-methyl-3-phenylmethoxypiperidine
CID 102954119
4-methyl-3-[(4-methyl-1,2,4-triazol-3-yl)methoxy]piperidine
CID 106939218
2-ethyl-5-(pyrrolidin-3-yloxymethyl)-1,3,4-oxadiazole
CID 62329287
4-methyl-3-(thiophen-2-ylmethoxy)piperidine
CID 102954007
3-[(4-methylpiperidin-3-yl)oxymethyl]-1,2,5-thiadiazole
CID 130942600
2-methyl-5-[[(1S,3R)-3-methylcyclohexyl]oxymethyl]-1,3,4-oxadiazole
CID 161499473
2-[(4-methylpiperidin-3-yl)oxymethyl]benzamide
CID 102954062
3-[(4-methylpiperidin-3-yl)oxymethyl]-5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyridine
CID 107078221
2-methyl-5-[(2-methylpropan-2-yl)oxymethyl]-1,3,4-oxadiazole
CID 131179232

Frequently Asked Questions

What is the IUPAC name of 2-methyl-5-[(4-methylpiperidin-3-yl)oxymethyl]-1,3,4-oxadiazole?
The IUPAC name of 2-methyl-5-[(4-methylpiperidin-3-yl)oxymethyl]-1,3,4-oxadiazole (CID 102954373) is 2-methyl-5-[(4-methylpiperidin-3-yl)oxymethyl]-1,3,4-oxadiazole.
What is the SMILES notation for 2-methyl-5-[(4-methylpiperidin-3-yl)oxymethyl]-1,3,4-oxadiazole?
The canonical SMILES for 2-methyl-5-[(4-methylpiperidin-3-yl)oxymethyl]-1,3,4-oxadiazole is Cc1nnc(COC2CNCCC2C)o1.
What is the InChIKey of 2-methyl-5-[(4-methylpiperidin-3-yl)oxymethyl]-1,3,4-oxadiazole?
The InChIKey is IUGJWSHFFRZXGO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N3O2/c1-7-3-4-11-5-9(7)14-6-10-13-12-8(2)15-10/h7,9,11H,3-6H2,1-2H3.
What are the key properties of 2-methyl-5-[(4-methylpiperidin-3-yl)oxymethyl]-1,3,4-oxadiazole?
2-methyl-5-[(4-methylpiperidin-3-yl)oxymethyl]-1,3,4-oxadiazole has a molecular weight of 211.26 g/mol, XLogP of 0.89, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-5-[(4-methylpiperidin-3-yl)oxymethyl]-1,3,4-oxadiazole is sourced from PubChem (CID 102954373), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).