2-(5-fluoro-3,6-dihydro-2H-pyridin-1-yl)-N-methylpropanamide

C9H15FN2O — CID 126992443

IUPAC2-(5-fluoro-3,6-dihydro-2H-pyridin-1-yl)-N-methylpropanamide
SMILESCNC(=O)C(C)N1CCC=C(F)C1
InChIInChI=1S/C9H15FN2O/c1-7(9(13)11-2)12-5-3-4-8(10)6-12/h4,7H,3,5-6H2,1-2H3,(H,11,13)
InChIKeyFFJGURMLQINURF-UHFFFAOYSA-N
MW186.23 g/mol
LogP0.68
Rot. Bonds2

About 2-(5-fluoro-3,6-dihydro-2H-pyridin-1-yl)-N-methylpropanamide

2-(5-fluoro-3,6-dihydro-2H-pyridin-1-yl)-N-methylpropanamide (PubChem CID 126992443) has the molecular formula C9H15FN2O and a molecular weight of 186.23 g/mol. Its IUPAC name is 2-(5-fluoro-3,6-dihydro-2H-pyridin-1-yl)-N-methylpropanamide.

Molecular Properties

Compound Name2-(5-fluoro-3,6-dihydro-2H-pyridin-1-yl)-N-methylpropanamide
PubChem CID126992443
Molecular FormulaC9H15FN2O
Molecular Weight186.23 g/mol
Exact Mass186.12
IUPAC Name2-(5-fluoro-3,6-dihydro-2H-pyridin-1-yl)-N-methylpropanamide
SMILESCNC(=O)C(C)N1CCC=C(F)C1
InChIInChI=1S/C9H15FN2O/c1-7(9(13)11-2)12-5-3-4-8(10)6-12/h4,7H,3,5-6H2,1-2H3,(H,11,13)
InChIKeyFFJGURMLQINURF-UHFFFAOYSA-N
XLogP0.68
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.23
LogP ≤ 50.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 2-(5-fluoro-3,6-dihydro-2H-pyridin-1-yl)-N-methylpropanamide 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-methyl-2-[4-(trifluoromethyl)-1,2,3,6-tetrahydropyridin-1-yl]acetamide
CID 126772187
4-Amino-1-ethyl-5-(methylamino)-2-(trifluoromethyl)-2,5-dihydropyridin-6-one
CID 122640414
(2S)-2-[[(E)-4,5,5-trifluoropent-2-enyl]amino]butanamide
CID 143150912
(3R,9S,12R,13Z,15S)-14-fluoro-3,9,12,15-tetramethyl-1,4,7,10-tetrazacyclopentadec-13-ene-2,5,8,11-tetrone
CID 46191522
(2R)-2-amino-1-[4-(trifluoromethyl)-3,6-dihydro-2H-pyridin-1-yl]propan-1-one
CID 104930308
(2R)-2-amino-1-[4-(trifluoromethyl)-3,6-dihydro-2H-pyridin-1-yl]butan-1-one
CID 104930312
(2S)-2-amino-1-[4-(trifluoromethyl)-3,6-dihydro-2H-pyridin-1-yl]propan-1-one
CID 104930315
(2S)-2-amino-1-[4-(trifluoromethyl)-3,6-dihydro-2H-pyridin-1-yl]butan-1-one
CID 104930321
1-(5-methyl-3,6-dihydro-2H-pyridin-1-yl)-2-(2,2,2-trifluoroethylamino)ethanone
CID 106313666
2-(ethylamino)-2-methyl-1-[4-(trifluoromethyl)-3,6-dihydro-2H-pyridin-1-yl]propan-1-one
CID 113591620
2-(propan-2-ylamino)-1-[4-(trifluoromethyl)-3,6-dihydro-2H-pyridin-1-yl]ethanone
CID 113591633
2-methyl-2-(methylamino)-1-[4-(trifluoromethyl)-3,6-dihydro-2H-pyridin-1-yl]propan-1-one
CID 114489809

Frequently Asked Questions

What is the IUPAC name of 2-(5-fluoro-3,6-dihydro-2H-pyridin-1-yl)-N-methylpropanamide?
The IUPAC name of 2-(5-fluoro-3,6-dihydro-2H-pyridin-1-yl)-N-methylpropanamide (CID 126992443) is 2-(5-fluoro-3,6-dihydro-2H-pyridin-1-yl)-N-methylpropanamide.
What is the SMILES notation for 2-(5-fluoro-3,6-dihydro-2H-pyridin-1-yl)-N-methylpropanamide?
The canonical SMILES for 2-(5-fluoro-3,6-dihydro-2H-pyridin-1-yl)-N-methylpropanamide is CNC(=O)C(C)N1CCC=C(F)C1.
What is the InChIKey of 2-(5-fluoro-3,6-dihydro-2H-pyridin-1-yl)-N-methylpropanamide?
The InChIKey is FFJGURMLQINURF-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15FN2O/c1-7(9(13)11-2)12-5-3-4-8(10)6-12/h4,7H,3,5-6H2,1-2H3,(H,11,13).
What are the key properties of 2-(5-fluoro-3,6-dihydro-2H-pyridin-1-yl)-N-methylpropanamide?
2-(5-fluoro-3,6-dihydro-2H-pyridin-1-yl)-N-methylpropanamide has a molecular weight of 186.23 g/mol, XLogP of 0.68, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-fluoro-3,6-dihydro-2H-pyridin-1-yl)-N-methylpropanamide is sourced from PubChem (CID 126992443), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).