4-fluoro-N-methyl-1-prop-1-en-2-ylpyridin-2-imine

C9H11FN2 — CID 156652493

IUPAC4-fluoro-N-methyl-1-prop-1-en-2-ylpyridin-2-imine
SMILESC=C(C)n1ccc(F)c/c1=N\C
InChIInChI=1S/C9H11FN2/c1-7(2)12-5-4-8(10)6-9(12)11-3/h4-6H,1H2,2-3H3/b11-9+
InChIKeyPYQAHDVOMBYTHI-PKNBQFBNSA-N
MW166.20 g/mol
LogP1.65
Rot. Bonds1

About 4-fluoro-N-methyl-1-prop-1-en-2-ylpyridin-2-imine

4-fluoro-N-methyl-1-prop-1-en-2-ylpyridin-2-imine (PubChem CID 156652493) has the molecular formula C9H11FN2 and a molecular weight of 166.20 g/mol. Its IUPAC name is 4-fluoro-N-methyl-1-prop-1-en-2-ylpyridin-2-imine.

Molecular Properties

Compound Name4-fluoro-N-methyl-1-prop-1-en-2-ylpyridin-2-imine
PubChem CID156652493
Molecular FormulaC9H11FN2
Molecular Weight166.20 g/mol
Exact Mass166.09
IUPAC Name4-fluoro-N-methyl-1-prop-1-en-2-ylpyridin-2-imine
SMILESC=C(C)n1ccc(F)c/c1=N\C
InChIInChI=1S/C9H11FN2/c1-7(2)12-5-4-8(10)6-9(12)11-3/h4-6H,1H2,2-3H3/b11-9+
InChIKeyPYQAHDVOMBYTHI-PKNBQFBNSA-N
XLogP1.65
TPSA17.29 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500166.20
LogP ≤ 51.65
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 4-fluoro-N-methyl-1-prop-1-en-2-ylpyridin-2-imine 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

1-methyl-N-(2,2,2-trifluoroethyl)pyridin-2-imine;hydrobromide
CID 90654286
Pyrido[1,2-a]pyrimidine
CID 20094215
4-Methyl-4h-pyrido[1,2-a]pyrimidine
CID 129791993
2,13-Diazatricyclo[7.3.1.05,13]trideca-1,3,5,7,9,11-hexaene
CID 135082283
4-methyl-2,2-bis(trifluoromethyl)-2H-pyrido[1,2-a][1,3,5]triazine
CID 5226153
1-ethenyl-5-fluoro-N-methylpyridin-2-imine
CID 68334595
4-Ethenyl-7-fluoroimidazo[1,2-a]pyridin-4-ium
CID 69092720
1-(C,N-dimethylcarbonimidoyl)-5-fluoropyridin-2-imine
CID 89441546
(2R)-5-fluoro-2-methyl-2,3-dihydroimidazo[1,2-a]pyridine
CID 89703885
(2R)-6-fluoro-2-methyl-2,3-dihydroimidazo[1,2-a]pyridine
CID 89703889
(2R)-7-fluoro-2-methyl-2,3-dihydroimidazo[1,2-a]pyridine
CID 89703895
(2R)-3-fluoro-2-methyl-2,3-dihydroimidazo[1,2-a]pyridine
CID 89703902

Frequently Asked Questions

What is the IUPAC name of 4-fluoro-N-methyl-1-prop-1-en-2-ylpyridin-2-imine?
The IUPAC name of 4-fluoro-N-methyl-1-prop-1-en-2-ylpyridin-2-imine (CID 156652493) is 4-fluoro-N-methyl-1-prop-1-en-2-ylpyridin-2-imine.
What is the SMILES notation for 4-fluoro-N-methyl-1-prop-1-en-2-ylpyridin-2-imine?
The canonical SMILES for 4-fluoro-N-methyl-1-prop-1-en-2-ylpyridin-2-imine is C=C(C)n1ccc(F)c/c1=N\C.
What is the InChIKey of 4-fluoro-N-methyl-1-prop-1-en-2-ylpyridin-2-imine?
The InChIKey is PYQAHDVOMBYTHI-PKNBQFBNSA-N. The full InChI is InChI=1S/C9H11FN2/c1-7(2)12-5-4-8(10)6-9(12)11-3/h4-6H,1H2,2-3H3/b11-9+.
What are the key properties of 4-fluoro-N-methyl-1-prop-1-en-2-ylpyridin-2-imine?
4-fluoro-N-methyl-1-prop-1-en-2-ylpyridin-2-imine has a molecular weight of 166.20 g/mol, XLogP of 1.65, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-fluoro-N-methyl-1-prop-1-en-2-ylpyridin-2-imine is sourced from PubChem (CID 156652493), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).