2-[3-(5-fluoro-2-pyridinyl)-1,2,4-oxadiazol-5-yl]-N-propylcyclopentan-1-amine

C15H19FN4O — CID 79713029

IUPAC2-[3-(5-fluoro-2-pyridinyl)-1,2,4-oxadiazol-5-yl]-N-propylcyclopentan-1-amine
SMILESCCCNC1CCCC1c1nc(-c2ccc(F)cn2)no1
InChIInChI=1S/C15H19FN4O/c1-2-8-17-12-5-3-4-11(12)15-19-14(20-21-15)13-7-6-10(16)9-18-13/h6-7,9,11-12,17H,2-5,8H2,1H3
InChIKeyIHZUEWFIUBDZNA-UHFFFAOYSA-N
MW290.34 g/mol
LogP2.91
Rot. Bonds5

About 2-[3-(5-fluoro-2-pyridinyl)-1,2,4-oxadiazol-5-yl]-N-propylcyclopentan-1-amine

2-[3-(5-fluoro-2-pyridinyl)-1,2,4-oxadiazol-5-yl]-N-propylcyclopentan-1-amine (PubChem CID 79713029) has the molecular formula C15H19FN4O and a molecular weight of 290.34 g/mol. Its IUPAC name is 2-[3-(5-fluoro-2-pyridinyl)-1,2,4-oxadiazol-5-yl]-N-propylcyclopentan-1-amine.

Molecular Properties

Compound Name2-[3-(5-fluoro-2-pyridinyl)-1,2,4-oxadiazol-5-yl]-N-propylcyclopentan-1-amine
PubChem CID79713029
Molecular FormulaC15H19FN4O
Molecular Weight290.34 g/mol
Exact Mass290.15
IUPAC Name2-[3-(5-fluoro-2-pyridinyl)-1,2,4-oxadiazol-5-yl]-N-propylcyclopentan-1-amine
SMILESCCCNC1CCCC1c1nc(-c2ccc(F)cn2)no1
InChIInChI=1S/C15H19FN4O/c1-2-8-17-12-5-3-4-11(12)15-19-14(20-21-15)13-7-6-10(16)9-18-13/h6-7,9,11-12,17H,2-5,8H2,1H3
InChIKeyIHZUEWFIUBDZNA-UHFFFAOYSA-N
XLogP2.91
TPSA63.84 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.34
LogP ≤ 52.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-[3-(5-fluoro-2-pyridinyl)-1,2,4-oxadiazol-5-yl]-N-propylcyclopentan-1-amine?
The IUPAC name of 2-[3-(5-fluoro-2-pyridinyl)-1,2,4-oxadiazol-5-yl]-N-propylcyclopentan-1-amine (CID 79713029) is 2-[3-(5-fluoro-2-pyridinyl)-1,2,4-oxadiazol-5-yl]-N-propylcyclopentan-1-amine.
What is the SMILES notation for 2-[3-(5-fluoro-2-pyridinyl)-1,2,4-oxadiazol-5-yl]-N-propylcyclopentan-1-amine?
The canonical SMILES for 2-[3-(5-fluoro-2-pyridinyl)-1,2,4-oxadiazol-5-yl]-N-propylcyclopentan-1-amine is CCCNC1CCCC1c1nc(-c2ccc(F)cn2)no1.
What is the InChIKey of 2-[3-(5-fluoro-2-pyridinyl)-1,2,4-oxadiazol-5-yl]-N-propylcyclopentan-1-amine?
The InChIKey is IHZUEWFIUBDZNA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19FN4O/c1-2-8-17-12-5-3-4-11(12)15-19-14(20-21-15)13-7-6-10(16)9-18-13/h6-7,9,11-12,17H,2-5,8H2,1H3.
What are the key properties of 2-[3-(5-fluoro-2-pyridinyl)-1,2,4-oxadiazol-5-yl]-N-propylcyclopentan-1-amine?
2-[3-(5-fluoro-2-pyridinyl)-1,2,4-oxadiazol-5-yl]-N-propylcyclopentan-1-amine has a molecular weight of 290.34 g/mol, XLogP of 2.91, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-(5-fluoro-2-pyridinyl)-1,2,4-oxadiazol-5-yl]-N-propylcyclopentan-1-amine is sourced from PubChem (CID 79713029), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).