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

C18H17FN4O — CID 155799638

IUPACN-cyclopentyl-3-[3-(3-fluorophenyl)-1,2,4-oxadiazol-5-yl]pyridin-2-amine
SMILESFc1cccc(-c2noc(-c3cccnc3NC3CCCC3)n2)c1
InChIInChI=1S/C18H17FN4O/c19-13-6-3-5-12(11-13)16-22-18(24-23-16)15-9-4-10-20-17(15)21-14-7-1-2-8-14/h3-6,9-11,14H,1-2,7-8H2,(H,20,21)
InChIKeyFORFQWIIOFTLJC-UHFFFAOYSA-N
MW324.36 g/mol
LogP4.29
Rot. Bonds4

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

N-cyclopentyl-3-[3-(3-fluorophenyl)-1,2,4-oxadiazol-5-yl]pyridin-2-amine (PubChem CID 155799638) has the molecular formula C18H17FN4O and a molecular weight of 324.36 g/mol. Its IUPAC name is N-cyclopentyl-3-[3-(3-fluorophenyl)-1,2,4-oxadiazol-5-yl]pyridin-2-amine.

Molecular Properties

Compound NameN-cyclopentyl-3-[3-(3-fluorophenyl)-1,2,4-oxadiazol-5-yl]pyridin-2-amine
PubChem CID155799638
Molecular FormulaC18H17FN4O
Molecular Weight324.36 g/mol
Exact Mass324.14
IUPAC NameN-cyclopentyl-3-[3-(3-fluorophenyl)-1,2,4-oxadiazol-5-yl]pyridin-2-amine
SMILESFc1cccc(-c2noc(-c3cccnc3NC3CCCC3)n2)c1
InChIInChI=1S/C18H17FN4O/c19-13-6-3-5-12(11-13)16-22-18(24-23-16)15-9-4-10-20-17(15)21-14-7-1-2-8-14/h3-6,9-11,14H,1-2,7-8H2,(H,20,21)
InChIKeyFORFQWIIOFTLJC-UHFFFAOYSA-N
XLogP4.29
TPSA63.84 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.36
LogP ≤ 54.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze N-cyclopentyl-3-[3-(3-fluorophenyl)-1,2,4-oxadiazol-5-yl]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

Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-3-[3-(3-fluorophenyl)-1,2,4-oxadiazol-5-yl]pyridin-2-amine?
The IUPAC name of N-cyclopentyl-3-[3-(3-fluorophenyl)-1,2,4-oxadiazol-5-yl]pyridin-2-amine (CID 155799638) is N-cyclopentyl-3-[3-(3-fluorophenyl)-1,2,4-oxadiazol-5-yl]pyridin-2-amine.
What is the SMILES notation for N-cyclopentyl-3-[3-(3-fluorophenyl)-1,2,4-oxadiazol-5-yl]pyridin-2-amine?
The canonical SMILES for N-cyclopentyl-3-[3-(3-fluorophenyl)-1,2,4-oxadiazol-5-yl]pyridin-2-amine is Fc1cccc(-c2noc(-c3cccnc3NC3CCCC3)n2)c1.
What is the InChIKey of N-cyclopentyl-3-[3-(3-fluorophenyl)-1,2,4-oxadiazol-5-yl]pyridin-2-amine?
The InChIKey is FORFQWIIOFTLJC-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H17FN4O/c19-13-6-3-5-12(11-13)16-22-18(24-23-16)15-9-4-10-20-17(15)21-14-7-1-2-8-14/h3-6,9-11,14H,1-2,7-8H2,(H,20,21).
What are the key properties of N-cyclopentyl-3-[3-(3-fluorophenyl)-1,2,4-oxadiazol-5-yl]pyridin-2-amine?
N-cyclopentyl-3-[3-(3-fluorophenyl)-1,2,4-oxadiazol-5-yl]pyridin-2-amine has a molecular weight of 324.36 g/mol, XLogP of 4.29, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-3-[3-(3-fluorophenyl)-1,2,4-oxadiazol-5-yl]pyridin-2-amine is sourced from PubChem (CID 155799638), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).