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

C10H17N3O2 — CID 107385695

IUPAC2-methyl-5-[(3-methylpiperidin-3-yl)oxymethyl]-1,3,4-oxadiazole
SMILESCc1nnc(COC2(C)CCCNC2)o1
InChIInChI=1S/C10H17N3O2/c1-8-12-13-9(15-8)6-14-10(2)4-3-5-11-7-10/h11H,3-7H2,1-2H3
InChIKeyFMZNPJSVMQADTA-UHFFFAOYSA-N
MW211.26 g/mol
LogP1.04
Rot. Bonds3

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

2-methyl-5-[(3-methylpiperidin-3-yl)oxymethyl]-1,3,4-oxadiazole (PubChem CID 107385695) has the molecular formula C10H17N3O2 and a molecular weight of 211.26 g/mol. Its IUPAC name is 2-methyl-5-[(3-methylpiperidin-3-yl)oxymethyl]-1,3,4-oxadiazole.

Molecular Properties

Compound Name2-methyl-5-[(3-methylpiperidin-3-yl)oxymethyl]-1,3,4-oxadiazole
PubChem CID107385695
Molecular FormulaC10H17N3O2
Molecular Weight211.26 g/mol
Exact Mass211.13
IUPAC Name2-methyl-5-[(3-methylpiperidin-3-yl)oxymethyl]-1,3,4-oxadiazole
SMILESCc1nnc(COC2(C)CCCNC2)o1
InChIInChI=1S/C10H17N3O2/c1-8-12-13-9(15-8)6-14-10(2)4-3-5-11-7-10/h11H,3-7H2,1-2H3
InChIKeyFMZNPJSVMQADTA-UHFFFAOYSA-N
XLogP1.04
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 ≤ 51.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-5-[(3-methylpiperidin-3-yl)oxymethyl]-1,3,4-oxadiazole?
The IUPAC name of 2-methyl-5-[(3-methylpiperidin-3-yl)oxymethyl]-1,3,4-oxadiazole (CID 107385695) is 2-methyl-5-[(3-methylpiperidin-3-yl)oxymethyl]-1,3,4-oxadiazole.
What is the SMILES notation for 2-methyl-5-[(3-methylpiperidin-3-yl)oxymethyl]-1,3,4-oxadiazole?
The canonical SMILES for 2-methyl-5-[(3-methylpiperidin-3-yl)oxymethyl]-1,3,4-oxadiazole is Cc1nnc(COC2(C)CCCNC2)o1.
What is the InChIKey of 2-methyl-5-[(3-methylpiperidin-3-yl)oxymethyl]-1,3,4-oxadiazole?
The InChIKey is FMZNPJSVMQADTA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N3O2/c1-8-12-13-9(15-8)6-14-10(2)4-3-5-11-7-10/h11H,3-7H2,1-2H3.
What are the key properties of 2-methyl-5-[(3-methylpiperidin-3-yl)oxymethyl]-1,3,4-oxadiazole?
2-methyl-5-[(3-methylpiperidin-3-yl)oxymethyl]-1,3,4-oxadiazole has a molecular weight of 211.26 g/mol, XLogP of 1.04, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-5-[(3-methylpiperidin-3-yl)oxymethyl]-1,3,4-oxadiazole is sourced from PubChem (CID 107385695), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).