3-(2-fluorophenyl)-N-(4-methoxyphenyl)-1,2,4-oxadiazol-5-amine

C15H12FN3O2 — CID 71582800

IUPAC3-(2-fluorophenyl)-N-(4-methoxyphenyl)-1,2,4-oxadiazol-5-amine
SMILESCOc1ccc(Nc2nc(-c3ccccc3F)no2)cc1
InChIInChI=1S/C15H12FN3O2/c1-20-11-8-6-10(7-9-11)17-15-18-14(19-21-15)12-4-2-3-5-13(12)16/h2-9H,1H3,(H,17,18,19)
InChIKeyFAWMGZFUBACUBV-UHFFFAOYSA-N
MW285.28 g/mol
LogP3.63
Rot. Bonds4

About 3-(2-fluorophenyl)-N-(4-methoxyphenyl)-1,2,4-oxadiazol-5-amine

3-(2-fluorophenyl)-N-(4-methoxyphenyl)-1,2,4-oxadiazol-5-amine (PubChem CID 71582800) has the molecular formula C15H12FN3O2 and a molecular weight of 285.28 g/mol. Its IUPAC name is 3-(2-fluorophenyl)-N-(4-methoxyphenyl)-1,2,4-oxadiazol-5-amine.

Molecular Properties

Compound Name3-(2-fluorophenyl)-N-(4-methoxyphenyl)-1,2,4-oxadiazol-5-amine
PubChem CID71582800
Molecular FormulaC15H12FN3O2
Molecular Weight285.28 g/mol
Exact Mass285.09
IUPAC Name3-(2-fluorophenyl)-N-(4-methoxyphenyl)-1,2,4-oxadiazol-5-amine
SMILESCOc1ccc(Nc2nc(-c3ccccc3F)no2)cc1
InChIInChI=1S/C15H12FN3O2/c1-20-11-8-6-10(7-9-11)17-15-18-14(19-21-15)12-4-2-3-5-13(12)16/h2-9H,1H3,(H,17,18,19)
InChIKeyFAWMGZFUBACUBV-UHFFFAOYSA-N
XLogP3.63
TPSA60.18 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.28
LogP ≤ 53.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

6-(4-methoxyphenyl)-2-N-[4-(trifluoromethoxy)phenyl]-1,3,5-triazine-2,4-diamine
CID 164628688
3-[5-(4-Fluoro-phenyl)-[1,2,4]oxadiazol-3-yl]-6-methoxy-quinolin-2-ol
CID 651756
N-{3-[4-(5-Methyl-[1,2,4]oxadiazol-3-yl)-phenoxy]-phenyl}-acetamide
CID 655521
3-[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]-N-(3-methylphenyl)propanamide
CID 665665
3-[3-(2-methoxyphenyl)-1,2,4-oxadiazol-5-yl]-N-[3-(trifluoromethyl)phenyl]propanamide
CID 666363
3-[3-(2-fluorophenyl)-1,2,4-oxadiazol-5-yl]-N-(2-methoxyphenyl)propanamide
CID 866833
3-[3-(4-fluorophenyl)-1,2,4-oxadiazol-5-yl]-N-(4-methoxyphenyl)piperidine-1-carboxamide
CID 3225914
3-[3-(2-fluorophenyl)-1,2,4-oxadiazol-5-yl]-N-(4-phenoxyphenyl)propanamide
CID 3241283
3-[3-(2-fluorophenyl)-1,2,4-oxadiazol-5-yl]-N-(3-methoxyphenyl)propanamide
CID 3806837
3-[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]-N-[4-(trifluoromethyl)phenyl]propanamide
CID 15990476
N-[3-(2,5-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]-N-(4-ethylphenyl)amine
CID 20910080
N-(3,4-dimethoxyphenyl)-3-(2-fluorophenyl)-1,2,4-oxadiazol-5-amine
CID 20952666

Frequently Asked Questions

What is the IUPAC name of 3-(2-fluorophenyl)-N-(4-methoxyphenyl)-1,2,4-oxadiazol-5-amine?
The IUPAC name of 3-(2-fluorophenyl)-N-(4-methoxyphenyl)-1,2,4-oxadiazol-5-amine (CID 71582800) is 3-(2-fluorophenyl)-N-(4-methoxyphenyl)-1,2,4-oxadiazol-5-amine.
What is the SMILES notation for 3-(2-fluorophenyl)-N-(4-methoxyphenyl)-1,2,4-oxadiazol-5-amine?
The canonical SMILES for 3-(2-fluorophenyl)-N-(4-methoxyphenyl)-1,2,4-oxadiazol-5-amine is COc1ccc(Nc2nc(-c3ccccc3F)no2)cc1.
What is the InChIKey of 3-(2-fluorophenyl)-N-(4-methoxyphenyl)-1,2,4-oxadiazol-5-amine?
The InChIKey is FAWMGZFUBACUBV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12FN3O2/c1-20-11-8-6-10(7-9-11)17-15-18-14(19-21-15)12-4-2-3-5-13(12)16/h2-9H,1H3,(H,17,18,19).
What are the key properties of 3-(2-fluorophenyl)-N-(4-methoxyphenyl)-1,2,4-oxadiazol-5-amine?
3-(2-fluorophenyl)-N-(4-methoxyphenyl)-1,2,4-oxadiazol-5-amine has a molecular weight of 285.28 g/mol, XLogP of 3.63, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-fluorophenyl)-N-(4-methoxyphenyl)-1,2,4-oxadiazol-5-amine is sourced from PubChem (CID 71582800), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).