1-(5-ethyl-1,2,4-oxadiazol-3-yl)cyclopentan-1-amine

C9H15N3O — CID 43559358

IUPAC1-(5-ethyl-1,2,4-oxadiazol-3-yl)cyclopentan-1-amine
SMILESCCc1nc(C2(N)CCCC2)no1
InChIInChI=1S/C9H15N3O/c1-2-7-11-8(12-13-7)9(10)5-3-4-6-9/h2-6,10H2,1H3
InChIKeyIHIDOZUVHPHRDK-UHFFFAOYSA-N
MW181.24 g/mol
LogP1.36
Rot. Bonds2

About 1-(5-ethyl-1,2,4-oxadiazol-3-yl)cyclopentan-1-amine

1-(5-ethyl-1,2,4-oxadiazol-3-yl)cyclopentan-1-amine (PubChem CID 43559358) has the molecular formula C9H15N3O and a molecular weight of 181.24 g/mol. Its IUPAC name is 1-(5-ethyl-1,2,4-oxadiazol-3-yl)cyclopentan-1-amine.

Molecular Properties

Compound Name1-(5-ethyl-1,2,4-oxadiazol-3-yl)cyclopentan-1-amine
PubChem CID43559358
Molecular FormulaC9H15N3O
Molecular Weight181.24 g/mol
Exact Mass181.12
IUPAC Name1-(5-ethyl-1,2,4-oxadiazol-3-yl)cyclopentan-1-amine
SMILESCCc1nc(C2(N)CCCC2)no1
InChIInChI=1S/C9H15N3O/c1-2-7-11-8(12-13-7)9(10)5-3-4-6-9/h2-6,10H2,1H3
InChIKeyIHIDOZUVHPHRDK-UHFFFAOYSA-N
XLogP1.36
TPSA64.94 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.24
LogP ≤ 51.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-(5-ethyl-1,2,4-oxadiazol-3-yl)cyclopentan-1-amine?
The IUPAC name of 1-(5-ethyl-1,2,4-oxadiazol-3-yl)cyclopentan-1-amine (CID 43559358) is 1-(5-ethyl-1,2,4-oxadiazol-3-yl)cyclopentan-1-amine.
What is the SMILES notation for 1-(5-ethyl-1,2,4-oxadiazol-3-yl)cyclopentan-1-amine?
The canonical SMILES for 1-(5-ethyl-1,2,4-oxadiazol-3-yl)cyclopentan-1-amine is CCc1nc(C2(N)CCCC2)no1.
What is the InChIKey of 1-(5-ethyl-1,2,4-oxadiazol-3-yl)cyclopentan-1-amine?
The InChIKey is IHIDOZUVHPHRDK-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15N3O/c1-2-7-11-8(12-13-7)9(10)5-3-4-6-9/h2-6,10H2,1H3.
What are the key properties of 1-(5-ethyl-1,2,4-oxadiazol-3-yl)cyclopentan-1-amine?
1-(5-ethyl-1,2,4-oxadiazol-3-yl)cyclopentan-1-amine has a molecular weight of 181.24 g/mol, XLogP of 1.36, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-ethyl-1,2,4-oxadiazol-3-yl)cyclopentan-1-amine is sourced from PubChem (CID 43559358), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).