5-[3-(oxolan-3-yl)-1,2,4-oxadiazol-5-yl]pyridin-2-amine

C11H12N4O2 — CID 65329882

IUPAC5-[3-(oxolan-3-yl)-1,2,4-oxadiazol-5-yl]pyridin-2-amine
SMILESNc1ccc(-c2nc(C3CCOC3)no2)cn1
InChIInChI=1S/C11H12N4O2/c12-9-2-1-7(5-13-9)11-14-10(15-17-11)8-3-4-16-6-8/h1-2,5,8H,3-4,6H2,(H2,12,13)
InChIKeyPZNVOSWFYPKAFJ-UHFFFAOYSA-N
MW232.24 g/mol
LogP1.22
Rot. Bonds2

About 5-[3-(oxolan-3-yl)-1,2,4-oxadiazol-5-yl]pyridin-2-amine

5-[3-(oxolan-3-yl)-1,2,4-oxadiazol-5-yl]pyridin-2-amine (PubChem CID 65329882) has the molecular formula C11H12N4O2 and a molecular weight of 232.24 g/mol. Its IUPAC name is 5-[3-(oxolan-3-yl)-1,2,4-oxadiazol-5-yl]pyridin-2-amine.

Molecular Properties

Compound Name5-[3-(oxolan-3-yl)-1,2,4-oxadiazol-5-yl]pyridin-2-amine
PubChem CID65329882
Molecular FormulaC11H12N4O2
Molecular Weight232.24 g/mol
Exact Mass232.10
IUPAC Name5-[3-(oxolan-3-yl)-1,2,4-oxadiazol-5-yl]pyridin-2-amine
SMILESNc1ccc(-c2nc(C3CCOC3)no2)cn1
InChIInChI=1S/C11H12N4O2/c12-9-2-1-7(5-13-9)11-14-10(15-17-11)8-3-4-16-6-8/h1-2,5,8H,3-4,6H2,(H2,12,13)
InChIKeyPZNVOSWFYPKAFJ-UHFFFAOYSA-N
XLogP1.22
TPSA87.06 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.24
LogP ≤ 51.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

2-bromo-5-[3-(oxolan-3-yl)-1,2,4-oxadiazol-5-yl]aniline
CID 107813760
5-(4-ethylphenyl)-3-[(3R)-oxolan-3-yl]-1,2,4-oxadiazole
CID 97443285
3-[(3R)-oxolan-3-yl]-5-quinoxalin-6-yl-1,2,4-oxadiazole
CID 97436994
5-(4-ethoxyphenyl)-3-(oxolan-3-yl)-1,2,4-oxadiazole
CID 72925037
5-(furan-3-yl)-3-[(3R)-oxolan-3-yl]-1,2,4-oxadiazole
CID 97018511
5-[3-(oxolan-3-yl)-1,2,4-oxadiazol-5-yl]-1H-pyrazol-3-amine
CID 65330662
3-[(3R)-oxolan-3-yl]-5-(4-pyrrolidin-1-ylphenyl)-1,2,4-oxadiazole
CID 97455442
5-(4-methylsulfonylphenyl)-3-[(3R)-oxolan-3-yl]-1,2,4-oxadiazole
CID 97437627
5-[3-(thian-2-yl)-1,2,4-oxadiazol-5-yl]pyridin-2-amine
CID 80620090
5-(1H-indol-5-yl)-3-[(3R)-oxolan-3-yl]-1,2,4-oxadiazole
CID 97455316
5-(5-methylpyrazin-2-yl)-3-(oxolan-3-yl)-1,2,4-oxadiazole
CID 72916447
N-methyl-4-[3-[(3R)-oxolan-3-yl]-1,2,4-oxadiazol-5-yl]pyridin-2-amine
CID 97456824

Frequently Asked Questions

What is the IUPAC name of 5-[3-(oxolan-3-yl)-1,2,4-oxadiazol-5-yl]pyridin-2-amine?
The IUPAC name of 5-[3-(oxolan-3-yl)-1,2,4-oxadiazol-5-yl]pyridin-2-amine (CID 65329882) is 5-[3-(oxolan-3-yl)-1,2,4-oxadiazol-5-yl]pyridin-2-amine.
What is the SMILES notation for 5-[3-(oxolan-3-yl)-1,2,4-oxadiazol-5-yl]pyridin-2-amine?
The canonical SMILES for 5-[3-(oxolan-3-yl)-1,2,4-oxadiazol-5-yl]pyridin-2-amine is Nc1ccc(-c2nc(C3CCOC3)no2)cn1.
What is the InChIKey of 5-[3-(oxolan-3-yl)-1,2,4-oxadiazol-5-yl]pyridin-2-amine?
The InChIKey is PZNVOSWFYPKAFJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12N4O2/c12-9-2-1-7(5-13-9)11-14-10(15-17-11)8-3-4-16-6-8/h1-2,5,8H,3-4,6H2,(H2,12,13).
What are the key properties of 5-[3-(oxolan-3-yl)-1,2,4-oxadiazol-5-yl]pyridin-2-amine?
5-[3-(oxolan-3-yl)-1,2,4-oxadiazol-5-yl]pyridin-2-amine has a molecular weight of 232.24 g/mol, XLogP of 1.22, 2 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[3-(oxolan-3-yl)-1,2,4-oxadiazol-5-yl]pyridin-2-amine is sourced from PubChem (CID 65329882), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).