(2,4-difluorophenyl)-(4-propylmorpholin-2-yl)methanone

C14H17F2NO2 — CID 79669007

IUPAC(2,4-difluorophenyl)-(4-propylmorpholin-2-yl)methanone
SMILESCCCN1CCOC(C(=O)c2ccc(F)cc2F)C1
InChIInChI=1S/C14H17F2NO2/c1-2-5-17-6-7-19-13(9-17)14(18)11-4-3-10(15)8-12(11)16/h3-4,8,13H,2,5-7,9H2,1H3
InChIKeyACKGCUUQXLUTTF-UHFFFAOYSA-N
MW269.29 g/mol
LogP2.26
Rot. Bonds4

About (2,4-difluorophenyl)-(4-propylmorpholin-2-yl)methanone

(2,4-difluorophenyl)-(4-propylmorpholin-2-yl)methanone (PubChem CID 79669007) has the molecular formula C14H17F2NO2 and a molecular weight of 269.29 g/mol. Its IUPAC name is (2,4-difluorophenyl)-(4-propylmorpholin-2-yl)methanone.

Molecular Properties

Compound Name(2,4-difluorophenyl)-(4-propylmorpholin-2-yl)methanone
PubChem CID79669007
Molecular FormulaC14H17F2NO2
Molecular Weight269.29 g/mol
Exact Mass269.12
IUPAC Name(2,4-difluorophenyl)-(4-propylmorpholin-2-yl)methanone
SMILESCCCN1CCOC(C(=O)c2ccc(F)cc2F)C1
InChIInChI=1S/C14H17F2NO2/c1-2-5-17-6-7-19-13(9-17)14(18)11-4-3-10(15)8-12(11)16/h3-4,8,13H,2,5-7,9H2,1H3
InChIKeyACKGCUUQXLUTTF-UHFFFAOYSA-N
XLogP2.26
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.29
LogP ≤ 52.26
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

(5-bromo-2-fluorophenyl)-(4-propylmorpholin-2-yl)methanone
CID 79742554
(2,6-difluoro-3-methylphenyl)-(4-propylmorpholin-2-yl)methanone
CID 82822768
2-(2-bromo-5-fluorophenyl)-1-(4-propylmorpholin-2-yl)ethanone
CID 79668927
(2,5-dimethoxyphenyl)-(4-propylmorpholin-2-yl)methanone
CID 79663278
2-(3-fluorophenyl)-1-(4-propylmorpholin-2-yl)ethanone
CID 79669537
(4-tert-butylphenyl)-(4-propylmorpholin-2-yl)methanone
CID 79663285
(2,4-difluorophenyl)-(1,4-dioxan-2-yl)methanone
CID 62799546
(5-methyl-3-pyridinyl)-(4-propylmorpholin-2-yl)methanone
CID 113297079
(4-propylmorpholin-2-yl)-(3-propyltriazol-4-yl)methanone
CID 114686036
2,3-dihydro-1-benzofuran-7-yl-(4-propylmorpholin-2-yl)methanone
CID 114744266
2-(3,5-dimethylphenyl)-1-(4-propylmorpholin-2-yl)ethanone
CID 79668855
(4-ethylmorpholin-2-yl)-(3-fluoro-5-methylphenyl)methanone
CID 79705374

Frequently Asked Questions

What is the IUPAC name of (2,4-difluorophenyl)-(4-propylmorpholin-2-yl)methanone?
The IUPAC name of (2,4-difluorophenyl)-(4-propylmorpholin-2-yl)methanone (CID 79669007) is (2,4-difluorophenyl)-(4-propylmorpholin-2-yl)methanone.
What is the SMILES notation for (2,4-difluorophenyl)-(4-propylmorpholin-2-yl)methanone?
The canonical SMILES for (2,4-difluorophenyl)-(4-propylmorpholin-2-yl)methanone is CCCN1CCOC(C(=O)c2ccc(F)cc2F)C1.
What is the InChIKey of (2,4-difluorophenyl)-(4-propylmorpholin-2-yl)methanone?
The InChIKey is ACKGCUUQXLUTTF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17F2NO2/c1-2-5-17-6-7-19-13(9-17)14(18)11-4-3-10(15)8-12(11)16/h3-4,8,13H,2,5-7,9H2,1H3.
What are the key properties of (2,4-difluorophenyl)-(4-propylmorpholin-2-yl)methanone?
(2,4-difluorophenyl)-(4-propylmorpholin-2-yl)methanone has a molecular weight of 269.29 g/mol, XLogP of 2.26, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2,4-difluorophenyl)-(4-propylmorpholin-2-yl)methanone is sourced from PubChem (CID 79669007), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).