1-(2-fluorophenyl)-3-(3-methylmorpholin-4-yl)propan-2-one

C14H18FNO2 — CID 43796410

IUPAC1-(2-fluorophenyl)-3-(3-methylmorpholin-4-yl)propan-2-one
SMILESCC1COCCN1CC(=O)Cc1ccccc1F
InChIInChI=1S/C14H18FNO2/c1-11-10-18-7-6-16(11)9-13(17)8-12-4-2-3-5-14(12)15/h2-5,11H,6-10H2,1H3
InChIKeyYWJRNLBYQDCKKG-UHFFFAOYSA-N
MW251.30 g/mol
LogP1.66
Rot. Bonds4

About 1-(2-fluorophenyl)-3-(3-methylmorpholin-4-yl)propan-2-one

1-(2-fluorophenyl)-3-(3-methylmorpholin-4-yl)propan-2-one (PubChem CID 43796410) has the molecular formula C14H18FNO2 and a molecular weight of 251.30 g/mol. Its IUPAC name is 1-(2-fluorophenyl)-3-(3-methylmorpholin-4-yl)propan-2-one.

Molecular Properties

Compound Name1-(2-fluorophenyl)-3-(3-methylmorpholin-4-yl)propan-2-one
PubChem CID43796410
Molecular FormulaC14H18FNO2
Molecular Weight251.30 g/mol
Exact Mass251.13
IUPAC Name1-(2-fluorophenyl)-3-(3-methylmorpholin-4-yl)propan-2-one
SMILESCC1COCCN1CC(=O)Cc1ccccc1F
InChIInChI=1S/C14H18FNO2/c1-11-10-18-7-6-16(11)9-13(17)8-12-4-2-3-5-14(12)15/h2-5,11H,6-10H2,1H3
InChIKeyYWJRNLBYQDCKKG-UHFFFAOYSA-N
XLogP1.66
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.30
LogP ≤ 51.66
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 1-(2-fluorophenyl)-3-(3-methylmorpholin-4-yl)propan-2-one 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-(2-fluorophenyl)-3-(3-methylmorpholin-4-yl)propan-1-one
CID 62619030
2-(2-fluorophenyl)-1-(3-phenylmorpholin-4-yl)ethanone
CID 110728374
1-(2-fluorophenyl)-3-(3,4,5-trimethylpiperazin-1-yl)propan-2-one
CID 114538567
2-(3-methylmorpholin-4-yl)-1-thiophen-2-ylethanone
CID 43796416
methyl 4-[(2-fluorophenyl)methyl]morpholine-3-carboxylate
CID 113247715
1-(2,3,3a,4,5,6,7,7a-octahydroindol-1-yl)-3-(2-fluorophenyl)propan-2-one
CID 82749677
4-fluoro-3-[(3-methylmorpholin-4-yl)methyl]benzohydrazide
CID 107458428
N-[(2-fluorophenyl)methyl]-2-[(3S)-3-[(1R,2S)-2-hydroxycyclopentyl]morpholin-4-yl]acetamide
CID 129483920
N-[(2-fluorophenyl)methyl]-2-[(3S)-3-[(1R,2R)-2-hydroxycyclopentyl]morpholin-4-yl]acetamide
CID 129483919
1-(2-fluorophenyl)-3-[2-(2-hydroxyethyl)piperidin-1-yl]propan-2-one
CID 62052719
1-ethyl-4-[3-(2-fluorophenyl)-2-oxopropyl]piperazine-2,3-dione
CID 62016943
1-(2-fluorophenyl)-3-(2,2,6,6-tetramethylmorpholin-4-yl)propan-2-one
CID 102744775

Frequently Asked Questions

What is the IUPAC name of 1-(2-fluorophenyl)-3-(3-methylmorpholin-4-yl)propan-2-one?
The IUPAC name of 1-(2-fluorophenyl)-3-(3-methylmorpholin-4-yl)propan-2-one (CID 43796410) is 1-(2-fluorophenyl)-3-(3-methylmorpholin-4-yl)propan-2-one.
What is the SMILES notation for 1-(2-fluorophenyl)-3-(3-methylmorpholin-4-yl)propan-2-one?
The canonical SMILES for 1-(2-fluorophenyl)-3-(3-methylmorpholin-4-yl)propan-2-one is CC1COCCN1CC(=O)Cc1ccccc1F.
What is the InChIKey of 1-(2-fluorophenyl)-3-(3-methylmorpholin-4-yl)propan-2-one?
The InChIKey is YWJRNLBYQDCKKG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18FNO2/c1-11-10-18-7-6-16(11)9-13(17)8-12-4-2-3-5-14(12)15/h2-5,11H,6-10H2,1H3.
What are the key properties of 1-(2-fluorophenyl)-3-(3-methylmorpholin-4-yl)propan-2-one?
1-(2-fluorophenyl)-3-(3-methylmorpholin-4-yl)propan-2-one has a molecular weight of 251.30 g/mol, XLogP of 1.66, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-fluorophenyl)-3-(3-methylmorpholin-4-yl)propan-2-one is sourced from PubChem (CID 43796410), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).