2-cyclohexyl-5-(methoxymethyl)-1,3,4-oxadiazole

C10H16N2O2 — CID 146389196

IUPAC2-cyclohexyl-5-(methoxymethyl)-1,3,4-oxadiazole
SMILESCOCc1nnc(C2CCCCC2)o1
InChIInChI=1S/C10H16N2O2/c1-13-7-9-11-12-10(14-9)8-5-3-2-4-6-8/h8H,2-7H2,1H3
InChIKeyBNQBZZPEZGQNLG-UHFFFAOYSA-N
MW196.25 g/mol
LogP2.26
Rot. Bonds3

About 2-cyclohexyl-5-(methoxymethyl)-1,3,4-oxadiazole

2-cyclohexyl-5-(methoxymethyl)-1,3,4-oxadiazole (PubChem CID 146389196) has the molecular formula C10H16N2O2 and a molecular weight of 196.25 g/mol. Its IUPAC name is 2-cyclohexyl-5-(methoxymethyl)-1,3,4-oxadiazole.

Molecular Properties

Compound Name2-cyclohexyl-5-(methoxymethyl)-1,3,4-oxadiazole
PubChem CID146389196
Molecular FormulaC10H16N2O2
Molecular Weight196.25 g/mol
Exact Mass196.12
IUPAC Name2-cyclohexyl-5-(methoxymethyl)-1,3,4-oxadiazole
SMILESCOCc1nnc(C2CCCCC2)o1
InChIInChI=1S/C10H16N2O2/c1-13-7-9-11-12-10(14-9)8-5-3-2-4-6-8/h8H,2-7H2,1H3
InChIKeyBNQBZZPEZGQNLG-UHFFFAOYSA-N
XLogP2.26
TPSA48.15 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.25
LogP ≤ 52.26
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-cyclohexyl-5-(methoxymethyl)-1,3,4-oxadiazole?
The IUPAC name of 2-cyclohexyl-5-(methoxymethyl)-1,3,4-oxadiazole (CID 146389196) is 2-cyclohexyl-5-(methoxymethyl)-1,3,4-oxadiazole.
What is the SMILES notation for 2-cyclohexyl-5-(methoxymethyl)-1,3,4-oxadiazole?
The canonical SMILES for 2-cyclohexyl-5-(methoxymethyl)-1,3,4-oxadiazole is COCc1nnc(C2CCCCC2)o1.
What is the InChIKey of 2-cyclohexyl-5-(methoxymethyl)-1,3,4-oxadiazole?
The InChIKey is BNQBZZPEZGQNLG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2O2/c1-13-7-9-11-12-10(14-9)8-5-3-2-4-6-8/h8H,2-7H2,1H3.
What are the key properties of 2-cyclohexyl-5-(methoxymethyl)-1,3,4-oxadiazole?
2-cyclohexyl-5-(methoxymethyl)-1,3,4-oxadiazole has a molecular weight of 196.25 g/mol, XLogP of 2.26, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclohexyl-5-(methoxymethyl)-1,3,4-oxadiazole is sourced from PubChem (CID 146389196), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).