5-(4-ethoxyphenyl)-1,3,4-oxadiazol-2-amine

C10H11N3O2 — CID 2369673

IUPAC5-(4-ethoxyphenyl)-1,3,4-oxadiazol-2-amine
SMILESCCOc1ccc(-c2nnc(N)o2)cc1
InChIInChI=1S/C10H11N3O2/c1-2-14-8-5-3-7(4-6-8)9-12-13-10(11)15-9/h3-6H,2H2,1H3,(H2,11,13)
InChIKeyMMYOEVKGOLHINN-UHFFFAOYSA-N
MW205.22 g/mol
LogP1.72
Rot. Bonds3

About 5-(4-ethoxyphenyl)-1,3,4-oxadiazol-2-amine

5-(4-ethoxyphenyl)-1,3,4-oxadiazol-2-amine (PubChem CID 2369673) has the molecular formula C10H11N3O2 and a molecular weight of 205.22 g/mol. Its IUPAC name is 5-(4-ethoxyphenyl)-1,3,4-oxadiazol-2-amine.

Molecular Properties

Compound Name5-(4-ethoxyphenyl)-1,3,4-oxadiazol-2-amine
PubChem CID2369673
Molecular FormulaC10H11N3O2
Molecular Weight205.22 g/mol
Exact Mass205.09
IUPAC Name5-(4-ethoxyphenyl)-1,3,4-oxadiazol-2-amine
SMILESCCOc1ccc(-c2nnc(N)o2)cc1
InChIInChI=1S/C10H11N3O2/c1-2-14-8-5-3-7(4-6-8)9-12-13-10(11)15-9/h3-6H,2H2,1H3,(H2,11,13)
InChIKeyMMYOEVKGOLHINN-UHFFFAOYSA-N
XLogP1.72
TPSA74.17 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.22
LogP ≤ 51.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-(4-Methoxyphenyl)-5-phenyl-1,3,4-oxadiazole
CID 70052
2-(4-Methoxyphenyl)-5-(4-methylphenyl)-1,3,4-oxadiazole
CID 622283
2-(4-Iodophenyl)-5-(4-methoxyphenyl)-1,3,4-oxadiazole
CID 46227022
1,3,4-Oxadiazole, 2-amino-5-(o-methoxyphenyl)-
CID 201251
2-(4-Methoxyphenyl)-1,3,4-oxadiazole
CID 766687
5-(3-Methoxyphenyl)-1,3,4-oxadiazol-2-amine
CID 256462
2-(4-Fluorophenyl)-5-(4-methoxyphenyl)-1,3,4-oxadiazole
CID 729586
2-[4-[(4-Fluorophenyl)methoxy]phenyl]-1,3,4-oxadiazole
CID 2740991
5-(3,4-Dimethoxyphenyl)-1,3,4-oxadiazol-2-amine
CID 356902
5-(4-Methoxyphenyl)-1,3,4-oxadiazol-2-amine
CID 679504
4-fluoro-N-(5-(4-methoxyphenyl)-1,3,4-oxadiazol-2-yl)benzamide
CID 4686761
2-(4-Ethoxy-phenyl)-5-phenyl-[1,3,4]oxadiazole
CID 865999

Frequently Asked Questions

What is the IUPAC name of 5-(4-ethoxyphenyl)-1,3,4-oxadiazol-2-amine?
The IUPAC name of 5-(4-ethoxyphenyl)-1,3,4-oxadiazol-2-amine (CID 2369673) is 5-(4-ethoxyphenyl)-1,3,4-oxadiazol-2-amine.
What is the SMILES notation for 5-(4-ethoxyphenyl)-1,3,4-oxadiazol-2-amine?
The canonical SMILES for 5-(4-ethoxyphenyl)-1,3,4-oxadiazol-2-amine is CCOc1ccc(-c2nnc(N)o2)cc1.
What is the InChIKey of 5-(4-ethoxyphenyl)-1,3,4-oxadiazol-2-amine?
The InChIKey is MMYOEVKGOLHINN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11N3O2/c1-2-14-8-5-3-7(4-6-8)9-12-13-10(11)15-9/h3-6H,2H2,1H3,(H2,11,13).
What are the key properties of 5-(4-ethoxyphenyl)-1,3,4-oxadiazol-2-amine?
5-(4-ethoxyphenyl)-1,3,4-oxadiazol-2-amine has a molecular weight of 205.22 g/mol, XLogP of 1.72, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(4-ethoxyphenyl)-1,3,4-oxadiazol-2-amine is sourced from PubChem (CID 2369673), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).