5-ethyl-4-(4-fluorophenyl)pyridin-3-amine

C13H13FN2 — CID 83917197

IUPAC5-ethyl-4-(4-fluorophenyl)pyridin-3-amine
SMILESCCc1cncc(N)c1-c1ccc(F)cc1
InChIInChI=1S/C13H13FN2/c1-2-9-7-16-8-12(15)13(9)10-3-5-11(14)6-4-10/h3-8H,2,15H2,1H3
InChIKeyOKKOWYBWLBZHFB-UHFFFAOYSA-N
MW216.26 g/mol
LogP3.03
Rot. Bonds2

About 5-ethyl-4-(4-fluorophenyl)pyridin-3-amine

5-ethyl-4-(4-fluorophenyl)pyridin-3-amine (PubChem CID 83917197) has the molecular formula C13H13FN2 and a molecular weight of 216.26 g/mol. Its IUPAC name is 5-ethyl-4-(4-fluorophenyl)pyridin-3-amine.

Molecular Properties

Compound Name5-ethyl-4-(4-fluorophenyl)pyridin-3-amine
PubChem CID83917197
Molecular FormulaC13H13FN2
Molecular Weight216.26 g/mol
Exact Mass216.11
IUPAC Name5-ethyl-4-(4-fluorophenyl)pyridin-3-amine
SMILESCCc1cncc(N)c1-c1ccc(F)cc1
InChIInChI=1S/C13H13FN2/c1-2-9-7-16-8-12(15)13(9)10-3-5-11(14)6-4-10/h3-8H,2,15H2,1H3
InChIKeyOKKOWYBWLBZHFB-UHFFFAOYSA-N
XLogP3.03
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.26
LogP ≤ 53.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5-ethyl-4-(4-fluorophenyl)pyridin-3-amine?
The IUPAC name of 5-ethyl-4-(4-fluorophenyl)pyridin-3-amine (CID 83917197) is 5-ethyl-4-(4-fluorophenyl)pyridin-3-amine.
What is the SMILES notation for 5-ethyl-4-(4-fluorophenyl)pyridin-3-amine?
The canonical SMILES for 5-ethyl-4-(4-fluorophenyl)pyridin-3-amine is CCc1cncc(N)c1-c1ccc(F)cc1.
What is the InChIKey of 5-ethyl-4-(4-fluorophenyl)pyridin-3-amine?
The InChIKey is OKKOWYBWLBZHFB-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H13FN2/c1-2-9-7-16-8-12(15)13(9)10-3-5-11(14)6-4-10/h3-8H,2,15H2,1H3.
What are the key properties of 5-ethyl-4-(4-fluorophenyl)pyridin-3-amine?
5-ethyl-4-(4-fluorophenyl)pyridin-3-amine has a molecular weight of 216.26 g/mol, XLogP of 3.03, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethyl-4-(4-fluorophenyl)pyridin-3-amine is sourced from PubChem (CID 83917197), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).