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

C10H12N4O2 — CID 79613889

IUPAC4-[3-(1-methoxyethyl)-1,2,4-oxadiazol-5-yl]pyridin-3-amine
SMILESCOC(C)c1noc(-c2ccncc2N)n1
InChIInChI=1S/C10H12N4O2/c1-6(15-2)9-13-10(16-14-9)7-3-4-12-5-8(7)11/h3-6H,11H2,1-2H3
InChIKeyWNGUKRBGIQLZTL-UHFFFAOYSA-N
MW220.23 g/mol
LogP1.42
Rot. Bonds3

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

4-[3-(1-methoxyethyl)-1,2,4-oxadiazol-5-yl]pyridin-3-amine (PubChem CID 79613889) has the molecular formula C10H12N4O2 and a molecular weight of 220.23 g/mol. Its IUPAC name is 4-[3-(1-methoxyethyl)-1,2,4-oxadiazol-5-yl]pyridin-3-amine.

Molecular Properties

Compound Name4-[3-(1-methoxyethyl)-1,2,4-oxadiazol-5-yl]pyridin-3-amine
PubChem CID79613889
Molecular FormulaC10H12N4O2
Molecular Weight220.23 g/mol
Exact Mass220.10
IUPAC Name4-[3-(1-methoxyethyl)-1,2,4-oxadiazol-5-yl]pyridin-3-amine
SMILESCOC(C)c1noc(-c2ccncc2N)n1
InChIInChI=1S/C10H12N4O2/c1-6(15-2)9-13-10(16-14-9)7-3-4-12-5-8(7)11/h3-6H,11H2,1-2H3
InChIKeyWNGUKRBGIQLZTL-UHFFFAOYSA-N
XLogP1.42
TPSA87.06 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.23
LogP ≤ 51.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 4-[3-(1-methoxyethyl)-1,2,4-oxadiazol-5-yl]pyridin-3-amine?
The IUPAC name of 4-[3-(1-methoxyethyl)-1,2,4-oxadiazol-5-yl]pyridin-3-amine (CID 79613889) is 4-[3-(1-methoxyethyl)-1,2,4-oxadiazol-5-yl]pyridin-3-amine.
What is the SMILES notation for 4-[3-(1-methoxyethyl)-1,2,4-oxadiazol-5-yl]pyridin-3-amine?
The canonical SMILES for 4-[3-(1-methoxyethyl)-1,2,4-oxadiazol-5-yl]pyridin-3-amine is COC(C)c1noc(-c2ccncc2N)n1.
What is the InChIKey of 4-[3-(1-methoxyethyl)-1,2,4-oxadiazol-5-yl]pyridin-3-amine?
The InChIKey is WNGUKRBGIQLZTL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12N4O2/c1-6(15-2)9-13-10(16-14-9)7-3-4-12-5-8(7)11/h3-6H,11H2,1-2H3.
What are the key properties of 4-[3-(1-methoxyethyl)-1,2,4-oxadiazol-5-yl]pyridin-3-amine?
4-[3-(1-methoxyethyl)-1,2,4-oxadiazol-5-yl]pyridin-3-amine has a molecular weight of 220.23 g/mol, XLogP of 1.42, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[3-(1-methoxyethyl)-1,2,4-oxadiazol-5-yl]pyridin-3-amine is sourced from PubChem (CID 79613889), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).