2-[[3-(3-methylcyclohexyl)-1,2,4-oxadiazol-5-yl]methyl]morpholine

C14H23N3O2 — CID 66434808

IUPAC2-[[3-(3-methylcyclohexyl)-1,2,4-oxadiazol-5-yl]methyl]morpholine
SMILESCC1CCCC(c2noc(CC3CNCCO3)n2)C1
InChIInChI=1S/C14H23N3O2/c1-10-3-2-4-11(7-10)14-16-13(19-17-14)8-12-9-15-5-6-18-12/h10-12,15H,2-9H2,1H3
InChIKeyFTIZFZOMEZAURT-UHFFFAOYSA-N
MW265.36 g/mol
LogP1.89
Rot. Bonds3

About 2-[[3-(3-methylcyclohexyl)-1,2,4-oxadiazol-5-yl]methyl]morpholine

2-[[3-(3-methylcyclohexyl)-1,2,4-oxadiazol-5-yl]methyl]morpholine (PubChem CID 66434808) has the molecular formula C14H23N3O2 and a molecular weight of 265.36 g/mol. Its IUPAC name is 2-[[3-(3-methylcyclohexyl)-1,2,4-oxadiazol-5-yl]methyl]morpholine.

Molecular Properties

Compound Name2-[[3-(3-methylcyclohexyl)-1,2,4-oxadiazol-5-yl]methyl]morpholine
PubChem CID66434808
Molecular FormulaC14H23N3O2
Molecular Weight265.36 g/mol
Exact Mass265.18
IUPAC Name2-[[3-(3-methylcyclohexyl)-1,2,4-oxadiazol-5-yl]methyl]morpholine
SMILESCC1CCCC(c2noc(CC3CNCCO3)n2)C1
InChIInChI=1S/C14H23N3O2/c1-10-3-2-4-11(7-10)14-16-13(19-17-14)8-12-9-15-5-6-18-12/h10-12,15H,2-9H2,1H3
InChIKeyFTIZFZOMEZAURT-UHFFFAOYSA-N
XLogP1.89
TPSA60.18 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.36
LogP ≤ 51.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-[[3-(3-methylcyclohexyl)-1,2,4-oxadiazol-5-yl]methyl]morpholine?
The IUPAC name of 2-[[3-(3-methylcyclohexyl)-1,2,4-oxadiazol-5-yl]methyl]morpholine (CID 66434808) is 2-[[3-(3-methylcyclohexyl)-1,2,4-oxadiazol-5-yl]methyl]morpholine.
What is the SMILES notation for 2-[[3-(3-methylcyclohexyl)-1,2,4-oxadiazol-5-yl]methyl]morpholine?
The canonical SMILES for 2-[[3-(3-methylcyclohexyl)-1,2,4-oxadiazol-5-yl]methyl]morpholine is CC1CCCC(c2noc(CC3CNCCO3)n2)C1.
What is the InChIKey of 2-[[3-(3-methylcyclohexyl)-1,2,4-oxadiazol-5-yl]methyl]morpholine?
The InChIKey is FTIZFZOMEZAURT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N3O2/c1-10-3-2-4-11(7-10)14-16-13(19-17-14)8-12-9-15-5-6-18-12/h10-12,15H,2-9H2,1H3.
What are the key properties of 2-[[3-(3-methylcyclohexyl)-1,2,4-oxadiazol-5-yl]methyl]morpholine?
2-[[3-(3-methylcyclohexyl)-1,2,4-oxadiazol-5-yl]methyl]morpholine has a molecular weight of 265.36 g/mol, XLogP of 1.89, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[3-(3-methylcyclohexyl)-1,2,4-oxadiazol-5-yl]methyl]morpholine is sourced from PubChem (CID 66434808), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).