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

C9H15N3O — CID 66033168

IUPAC3-(3-ethyl-1,2,4-oxadiazol-5-yl)cyclopentan-1-amine
SMILESCCc1noc(C2CCC(N)C2)n1
InChIInChI=1S/C9H15N3O/c1-2-8-11-9(13-12-8)6-3-4-7(10)5-6/h6-7H,2-5,10H2,1H3
InChIKeyMUWLMGYRXAWPAY-UHFFFAOYSA-N
MW181.24 g/mol
LogP1.23
Rot. Bonds2

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

3-(3-ethyl-1,2,4-oxadiazol-5-yl)cyclopentan-1-amine (PubChem CID 66033168) has the molecular formula C9H15N3O and a molecular weight of 181.24 g/mol. Its IUPAC name is 3-(3-ethyl-1,2,4-oxadiazol-5-yl)cyclopentan-1-amine.

Molecular Properties

Compound Name3-(3-ethyl-1,2,4-oxadiazol-5-yl)cyclopentan-1-amine
PubChem CID66033168
Molecular FormulaC9H15N3O
Molecular Weight181.24 g/mol
Exact Mass181.12
IUPAC Name3-(3-ethyl-1,2,4-oxadiazol-5-yl)cyclopentan-1-amine
SMILESCCc1noc(C2CCC(N)C2)n1
InChIInChI=1S/C9H15N3O/c1-2-8-11-9(13-12-8)6-3-4-7(10)5-6/h6-7H,2-5,10H2,1H3
InChIKeyMUWLMGYRXAWPAY-UHFFFAOYSA-N
XLogP1.23
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 ≤ 51.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3-(3-ethyl-1,2,4-oxadiazol-5-yl)cyclopentan-1-amine?
The IUPAC name of 3-(3-ethyl-1,2,4-oxadiazol-5-yl)cyclopentan-1-amine (CID 66033168) is 3-(3-ethyl-1,2,4-oxadiazol-5-yl)cyclopentan-1-amine.
What is the SMILES notation for 3-(3-ethyl-1,2,4-oxadiazol-5-yl)cyclopentan-1-amine?
The canonical SMILES for 3-(3-ethyl-1,2,4-oxadiazol-5-yl)cyclopentan-1-amine is CCc1noc(C2CCC(N)C2)n1.
What is the InChIKey of 3-(3-ethyl-1,2,4-oxadiazol-5-yl)cyclopentan-1-amine?
The InChIKey is MUWLMGYRXAWPAY-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15N3O/c1-2-8-11-9(13-12-8)6-3-4-7(10)5-6/h6-7H,2-5,10H2,1H3.
What are the key properties of 3-(3-ethyl-1,2,4-oxadiazol-5-yl)cyclopentan-1-amine?
3-(3-ethyl-1,2,4-oxadiazol-5-yl)cyclopentan-1-amine has a molecular weight of 181.24 g/mol, XLogP of 1.23, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3-ethyl-1,2,4-oxadiazol-5-yl)cyclopentan-1-amine is sourced from PubChem (CID 66033168), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).