5-[3-(3-fluorophenyl)-1,2,4-oxadiazol-5-yl]-N-(2-thiophen-2-ylethyl)pyridin-2-amine

C19H15FN4OS — CID 53126788

IUPAC5-[3-(3-fluorophenyl)-1,2,4-oxadiazol-5-yl]-N-(2-thiophen-2-ylethyl)pyridin-2-amine
SMILESFc1cccc(-c2noc(-c3ccc(NCCc4cccs4)nc3)n2)c1
InChIInChI=1S/C19H15FN4OS/c20-15-4-1-3-13(11-15)18-23-19(25-24-18)14-6-7-17(22-12-14)21-9-8-16-5-2-10-26-16/h1-7,10-12H,8-9H2,(H,21,22)
InChIKeySNGQPTZSYZYXRX-UHFFFAOYSA-N
MW366.42 g/mol
LogP4.65
Rot. Bonds6

About 5-[3-(3-fluorophenyl)-1,2,4-oxadiazol-5-yl]-N-(2-thiophen-2-ylethyl)pyridin-2-amine

5-[3-(3-fluorophenyl)-1,2,4-oxadiazol-5-yl]-N-(2-thiophen-2-ylethyl)pyridin-2-amine (PubChem CID 53126788) has the molecular formula C19H15FN4OS and a molecular weight of 366.42 g/mol. Its IUPAC name is 5-[3-(3-fluorophenyl)-1,2,4-oxadiazol-5-yl]-N-(2-thiophen-2-ylethyl)pyridin-2-amine.

Molecular Properties

Compound Name5-[3-(3-fluorophenyl)-1,2,4-oxadiazol-5-yl]-N-(2-thiophen-2-ylethyl)pyridin-2-amine
PubChem CID53126788
Molecular FormulaC19H15FN4OS
Molecular Weight366.42 g/mol
Exact Mass366.10
IUPAC Name5-[3-(3-fluorophenyl)-1,2,4-oxadiazol-5-yl]-N-(2-thiophen-2-ylethyl)pyridin-2-amine
SMILESFc1cccc(-c2noc(-c3ccc(NCCc4cccs4)nc3)n2)c1
InChIInChI=1S/C19H15FN4OS/c20-15-4-1-3-13(11-15)18-23-19(25-24-18)14-6-7-17(22-12-14)21-9-8-16-5-2-10-26-16/h1-7,10-12H,8-9H2,(H,21,22)
InChIKeySNGQPTZSYZYXRX-UHFFFAOYSA-N
XLogP4.65
TPSA63.84 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500366.42
LogP ≤ 54.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 5-[3-(3-fluorophenyl)-1,2,4-oxadiazol-5-yl]-N-(2-thiophen-2-ylethyl)pyridin-2-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[3-(azepan-1-yl)butyl]-5-[3-(3-fluorophenyl)-1,2,4-oxadiazol-5-yl]pyridin-2-amine
CID 53126789
5-[3-(3-fluorophenyl)-1,2,4-oxadiazol-5-yl]-N-(pyridin-2-ylmethyl)pyridin-2-amine
CID 53037214
5-[3-(3-fluorophenyl)-1,2,4-oxadiazol-5-yl]-N-[3-(4-phenylpiperazin-1-yl)propyl]pyridin-2-amine
CID 53126785
N-(1,3-benzodioxol-5-ylmethyl)-5-[3-(3-fluorophenyl)-1,2,4-oxadiazol-5-yl]pyridin-2-amine
CID 53126758
5-[3-(3-fluorophenyl)-1,2,4-oxadiazol-5-yl]-N-[3-[(3S)-3-methylpiperidin-1-yl]propyl]pyridin-2-amine
CID 95056750
5-[3-(3-fluorophenyl)-1,2,4-oxadiazol-5-yl]-N-[3-[(3R)-3-methylpiperidin-1-yl]propyl]pyridin-2-amine
CID 95056749
3-(3-fluorophenyl)-5-[3-(3-fluorophenyl)-1,2,4-oxadiazol-5-yl]-1,2,4-oxadiazole
CID 139220637
N-[(4-fluorophenyl)methyl]-5-(3-phenyl-1,2,4-oxadiazol-5-yl)pyridin-2-amine
CID 53037152
3-[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]-N-(2-thiophen-2-ylethyl)benzenesulfonamide
CID 50839105
N-[4-[5-(3-fluorophenyl)-1,2,4-oxadiazol-3-yl]phenyl]thiophene-2-sulfonamide
CID 46380545
5-[3-(4-fluorophenyl)-1,2,4-oxadiazol-5-yl]-N-[(4-methylphenyl)methyl]pyridin-2-amine
CID 53037257
4-[3-(3-fluorophenyl)-1,2,4-oxadiazol-5-yl]-2-methylaniline
CID 43514837

Frequently Asked Questions

What is the IUPAC name of 5-[3-(3-fluorophenyl)-1,2,4-oxadiazol-5-yl]-N-(2-thiophen-2-ylethyl)pyridin-2-amine?
The IUPAC name of 5-[3-(3-fluorophenyl)-1,2,4-oxadiazol-5-yl]-N-(2-thiophen-2-ylethyl)pyridin-2-amine (CID 53126788) is 5-[3-(3-fluorophenyl)-1,2,4-oxadiazol-5-yl]-N-(2-thiophen-2-ylethyl)pyridin-2-amine.
What is the SMILES notation for 5-[3-(3-fluorophenyl)-1,2,4-oxadiazol-5-yl]-N-(2-thiophen-2-ylethyl)pyridin-2-amine?
The canonical SMILES for 5-[3-(3-fluorophenyl)-1,2,4-oxadiazol-5-yl]-N-(2-thiophen-2-ylethyl)pyridin-2-amine is Fc1cccc(-c2noc(-c3ccc(NCCc4cccs4)nc3)n2)c1.
What is the InChIKey of 5-[3-(3-fluorophenyl)-1,2,4-oxadiazol-5-yl]-N-(2-thiophen-2-ylethyl)pyridin-2-amine?
The InChIKey is SNGQPTZSYZYXRX-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H15FN4OS/c20-15-4-1-3-13(11-15)18-23-19(25-24-18)14-6-7-17(22-12-14)21-9-8-16-5-2-10-26-16/h1-7,10-12H,8-9H2,(H,21,22).
What are the key properties of 5-[3-(3-fluorophenyl)-1,2,4-oxadiazol-5-yl]-N-(2-thiophen-2-ylethyl)pyridin-2-amine?
5-[3-(3-fluorophenyl)-1,2,4-oxadiazol-5-yl]-N-(2-thiophen-2-ylethyl)pyridin-2-amine has a molecular weight of 366.42 g/mol, XLogP of 4.65, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[3-(3-fluorophenyl)-1,2,4-oxadiazol-5-yl]-N-(2-thiophen-2-ylethyl)pyridin-2-amine is sourced from PubChem (CID 53126788), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).