5-[2-(3-fluorophenyl)morpholine-4-carbonyl]-2-methyl-1H-pyridin-4-one

C17H17FN2O3 — CID 71926655

IUPAC5-[2-(3-fluorophenyl)morpholine-4-carbonyl]-2-methyl-1H-pyridin-4-one
SMILESCc1cc(=O)c(C(=O)N2CCOC(c3cccc(F)c3)C2)c[nH]1
InChIInChI=1S/C17H17FN2O3/c1-11-7-15(21)14(9-19-11)17(22)20-5-6-23-16(10-20)12-3-2-4-13(18)8-12/h2-4,7-9,16H,5-6,10H2,1H3,(H,19,21)
InChIKeyQCSMQWJGRYXEPA-UHFFFAOYSA-N
MW316.33 g/mol
LogP2.04
Rot. Bonds2

About 5-[2-(3-fluorophenyl)morpholine-4-carbonyl]-2-methyl-1H-pyridin-4-one

5-[2-(3-fluorophenyl)morpholine-4-carbonyl]-2-methyl-1H-pyridin-4-one (PubChem CID 71926655) has the molecular formula C17H17FN2O3 and a molecular weight of 316.33 g/mol. Its IUPAC name is 5-[2-(3-fluorophenyl)morpholine-4-carbonyl]-2-methyl-1H-pyridin-4-one.

Molecular Properties

Compound Name5-[2-(3-fluorophenyl)morpholine-4-carbonyl]-2-methyl-1H-pyridin-4-one
PubChem CID71926655
Molecular FormulaC17H17FN2O3
Molecular Weight316.33 g/mol
Exact Mass316.12
IUPAC Name5-[2-(3-fluorophenyl)morpholine-4-carbonyl]-2-methyl-1H-pyridin-4-one
SMILESCc1cc(=O)c(C(=O)N2CCOC(c3cccc(F)c3)C2)c[nH]1
InChIInChI=1S/C17H17FN2O3/c1-11-7-15(21)14(9-19-11)17(22)20-5-6-23-16(10-20)12-3-2-4-13(18)8-12/h2-4,7-9,16H,5-6,10H2,1H3,(H,19,21)
InChIKeyQCSMQWJGRYXEPA-UHFFFAOYSA-N
XLogP2.04
TPSA62.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.33
LogP ≤ 52.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-[(2R)-2-(3-fluorophenyl)morpholine-4-carbonyl]-2-methyl-1H-pyridin-4-one
CID 97067462
2-methyl-5-[(2R)-2-(2-methylphenyl)morpholine-4-carbonyl]-1H-pyridin-4-one
CID 97072792
4-[2-(3-fluorophenyl)morpholine-4-carbonyl]benzoic acid
CID 119183981
N,N-diethyl-2-[3-[2-(3-fluorophenyl)morpholine-4-carbonyl]-2-oxo-1-pyridinyl]acetamide
CID 167862463
[2-(3-fluorophenyl)morpholin-4-yl]-(2-methyl-5-nitro-3-pyridinyl)methanone
CID 155945273
3-[(2R)-2-(4-fluorophenyl)morpholine-4-carbonyl]-1H-pyridin-2-one
CID 38374130
1-[2-(3-fluorophenyl)morpholin-4-yl]-2,3,3-trimethylbutan-1-one
CID 136526058
3-amino-1-[2-(3-fluorophenyl)morpholin-4-yl]propan-1-one;hydrochloride
CID 119315907
2-amino-1-[2-(3-fluorophenyl)morpholin-4-yl]-2-(4-methylphenyl)ethanone
CID 120668206
(1-aminocyclopropyl)-[2-(3-fluorophenyl)morpholin-4-yl]methanone;hydrochloride
CID 119770397
[2-(4-fluorophenyl)morpholin-4-yl]-(3-hydroxynaphthalen-2-yl)methanone
CID 47023687
1-chloroethenyl (2S)-2-(3-fluorophenyl)morpholine-4-carboxylate
CID 174559637

Frequently Asked Questions

What is the IUPAC name of 5-[2-(3-fluorophenyl)morpholine-4-carbonyl]-2-methyl-1H-pyridin-4-one?
The IUPAC name of 5-[2-(3-fluorophenyl)morpholine-4-carbonyl]-2-methyl-1H-pyridin-4-one (CID 71926655) is 5-[2-(3-fluorophenyl)morpholine-4-carbonyl]-2-methyl-1H-pyridin-4-one.
What is the SMILES notation for 5-[2-(3-fluorophenyl)morpholine-4-carbonyl]-2-methyl-1H-pyridin-4-one?
The canonical SMILES for 5-[2-(3-fluorophenyl)morpholine-4-carbonyl]-2-methyl-1H-pyridin-4-one is Cc1cc(=O)c(C(=O)N2CCOC(c3cccc(F)c3)C2)c[nH]1.
What is the InChIKey of 5-[2-(3-fluorophenyl)morpholine-4-carbonyl]-2-methyl-1H-pyridin-4-one?
The InChIKey is QCSMQWJGRYXEPA-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17FN2O3/c1-11-7-15(21)14(9-19-11)17(22)20-5-6-23-16(10-20)12-3-2-4-13(18)8-12/h2-4,7-9,16H,5-6,10H2,1H3,(H,19,21).
What are the key properties of 5-[2-(3-fluorophenyl)morpholine-4-carbonyl]-2-methyl-1H-pyridin-4-one?
5-[2-(3-fluorophenyl)morpholine-4-carbonyl]-2-methyl-1H-pyridin-4-one has a molecular weight of 316.33 g/mol, XLogP of 2.04, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[2-(3-fluorophenyl)morpholine-4-carbonyl]-2-methyl-1H-pyridin-4-one is sourced from PubChem (CID 71926655), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).