5-fluoro-3-methyl-2,3-dihydropyridin-6-amine

C6H9FN2 — CID 122536116

IUPAC5-fluoro-3-methyl-2,3-dihydropyridin-6-amine
SMILESCC1C=C(F)C(N)=NC1
InChIInChI=1S/C6H9FN2/c1-4-2-5(7)6(8)9-3-4/h2,4H,3H2,1H3,(H2,8,9)
InChIKeyFGGYMEPPAAROFP-UHFFFAOYSA-N
MW128.15 g/mol
LogP0.85
Rot. Bonds

About 5-fluoro-3-methyl-2,3-dihydropyridin-6-amine

5-fluoro-3-methyl-2,3-dihydropyridin-6-amine (PubChem CID 122536116) has the molecular formula C6H9FN2 and a molecular weight of 128.15 g/mol. Its IUPAC name is 5-fluoro-3-methyl-2,3-dihydropyridin-6-amine.

Molecular Properties

Compound Name5-fluoro-3-methyl-2,3-dihydropyridin-6-amine
PubChem CID122536116
Molecular FormulaC6H9FN2
Molecular Weight128.15 g/mol
Exact Mass128.07
IUPAC Name5-fluoro-3-methyl-2,3-dihydropyridin-6-amine
SMILESCC1C=C(F)C(N)=NC1
InChIInChI=1S/C6H9FN2/c1-4-2-5(7)6(8)9-3-4/h2,4H,3H2,1H3,(H2,8,9)
InChIKeyFGGYMEPPAAROFP-UHFFFAOYSA-N
XLogP0.85
TPSA38.38 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500128.15
LogP ≤ 50.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 5-fluoro-3-methyl-2,3-dihydropyridin-6-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 5-fluoro-3-methyl-2,3-dihydropyridin-6-amine?
The IUPAC name of 5-fluoro-3-methyl-2,3-dihydropyridin-6-amine (CID 122536116) is 5-fluoro-3-methyl-2,3-dihydropyridin-6-amine.
What is the SMILES notation for 5-fluoro-3-methyl-2,3-dihydropyridin-6-amine?
The canonical SMILES for 5-fluoro-3-methyl-2,3-dihydropyridin-6-amine is CC1C=C(F)C(N)=NC1.
What is the InChIKey of 5-fluoro-3-methyl-2,3-dihydropyridin-6-amine?
The InChIKey is FGGYMEPPAAROFP-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H9FN2/c1-4-2-5(7)6(8)9-3-4/h2,4H,3H2,1H3,(H2,8,9).
What are the key properties of 5-fluoro-3-methyl-2,3-dihydropyridin-6-amine?
5-fluoro-3-methyl-2,3-dihydropyridin-6-amine has a molecular weight of 128.15 g/mol, XLogP of 0.85, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-fluoro-3-methyl-2,3-dihydropyridin-6-amine is sourced from PubChem (CID 122536116), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).