2-methoxy-N-[2-(1,2,4-oxadiazol-3-yl)ethyl]cyclohexan-1-amine

C11H19N3O2 — CID 106395406

IUPAC2-methoxy-N-[2-(1,2,4-oxadiazol-3-yl)ethyl]cyclohexan-1-amine
SMILESCOC1CCCCC1NCCc1ncon1
InChIInChI=1S/C11H19N3O2/c1-15-10-5-3-2-4-9(10)12-7-6-11-13-8-16-14-11/h8-10,12H,2-7H2,1H3
InChIKeyFZGIBGJNVYSHNY-UHFFFAOYSA-N
MW225.29 g/mol
LogP1.16
Rot. Bonds5

About 2-methoxy-N-[2-(1,2,4-oxadiazol-3-yl)ethyl]cyclohexan-1-amine

2-methoxy-N-[2-(1,2,4-oxadiazol-3-yl)ethyl]cyclohexan-1-amine (PubChem CID 106395406) has the molecular formula C11H19N3O2 and a molecular weight of 225.29 g/mol. Its IUPAC name is 2-methoxy-N-[2-(1,2,4-oxadiazol-3-yl)ethyl]cyclohexan-1-amine.

Molecular Properties

Compound Name2-methoxy-N-[2-(1,2,4-oxadiazol-3-yl)ethyl]cyclohexan-1-amine
PubChem CID106395406
Molecular FormulaC11H19N3O2
Molecular Weight225.29 g/mol
Exact Mass225.15
IUPAC Name2-methoxy-N-[2-(1,2,4-oxadiazol-3-yl)ethyl]cyclohexan-1-amine
SMILESCOC1CCCCC1NCCc1ncon1
InChIInChI=1S/C11H19N3O2/c1-15-10-5-3-2-4-9(10)12-7-6-11-13-8-16-14-11/h8-10,12H,2-7H2,1H3
InChIKeyFZGIBGJNVYSHNY-UHFFFAOYSA-N
XLogP1.16
TPSA60.18 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.29
LogP ≤ 51.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-methoxy-N-[2-(1,2,4-oxadiazol-3-yl)ethyl]cyclohexan-1-amine?
The IUPAC name of 2-methoxy-N-[2-(1,2,4-oxadiazol-3-yl)ethyl]cyclohexan-1-amine (CID 106395406) is 2-methoxy-N-[2-(1,2,4-oxadiazol-3-yl)ethyl]cyclohexan-1-amine.
What is the SMILES notation for 2-methoxy-N-[2-(1,2,4-oxadiazol-3-yl)ethyl]cyclohexan-1-amine?
The canonical SMILES for 2-methoxy-N-[2-(1,2,4-oxadiazol-3-yl)ethyl]cyclohexan-1-amine is COC1CCCCC1NCCc1ncon1.
What is the InChIKey of 2-methoxy-N-[2-(1,2,4-oxadiazol-3-yl)ethyl]cyclohexan-1-amine?
The InChIKey is FZGIBGJNVYSHNY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3O2/c1-15-10-5-3-2-4-9(10)12-7-6-11-13-8-16-14-11/h8-10,12H,2-7H2,1H3.
What are the key properties of 2-methoxy-N-[2-(1,2,4-oxadiazol-3-yl)ethyl]cyclohexan-1-amine?
2-methoxy-N-[2-(1,2,4-oxadiazol-3-yl)ethyl]cyclohexan-1-amine has a molecular weight of 225.29 g/mol, XLogP of 1.16, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-N-[2-(1,2,4-oxadiazol-3-yl)ethyl]cyclohexan-1-amine is sourced from PubChem (CID 106395406), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).