[2-[(2,4-difluorophenoxy)methyl]morpholin-4-yl]-(furan-2-yl)methanone

C16H15F2NO4 — CID 46041071

IUPAC[2-[(2,4-difluorophenoxy)methyl]morpholin-4-yl]-(furan-2-yl)methanone
SMILESO=C(c1ccco1)N1CCOC(COc2ccc(F)cc2F)C1
InChIInChI=1S/C16H15F2NO4/c17-11-3-4-14(13(18)8-11)23-10-12-9-19(5-7-21-12)16(20)15-2-1-6-22-15/h1-4,6,8,12H,5,7,9-10H2
InChIKeySLXCHKZLQTVUSA-UHFFFAOYSA-N
MW323.29 g/mol
LogP2.48
Rot. Bonds4

About [2-[(2,4-difluorophenoxy)methyl]morpholin-4-yl]-(furan-2-yl)methanone

[2-[(2,4-difluorophenoxy)methyl]morpholin-4-yl]-(furan-2-yl)methanone (PubChem CID 46041071) has the molecular formula C16H15F2NO4 and a molecular weight of 323.29 g/mol. Its IUPAC name is [2-[(2,4-difluorophenoxy)methyl]morpholin-4-yl]-(furan-2-yl)methanone.

Molecular Properties

Compound Name[2-[(2,4-difluorophenoxy)methyl]morpholin-4-yl]-(furan-2-yl)methanone
PubChem CID46041071
Molecular FormulaC16H15F2NO4
Molecular Weight323.29 g/mol
Exact Mass323.10
IUPAC Name[2-[(2,4-difluorophenoxy)methyl]morpholin-4-yl]-(furan-2-yl)methanone
SMILESO=C(c1ccco1)N1CCOC(COc2ccc(F)cc2F)C1
InChIInChI=1S/C16H15F2NO4/c17-11-3-4-14(13(18)8-11)23-10-12-9-19(5-7-21-12)16(20)15-2-1-6-22-15/h1-4,6,8,12H,5,7,9-10H2
InChIKeySLXCHKZLQTVUSA-UHFFFAOYSA-N
XLogP2.48
TPSA51.91 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500323.29
LogP ≤ 52.48
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

(4-chlorophenyl)-[2-[(2,4-difluorophenoxy)methyl]morpholin-4-yl]methanone
CID 46059327
2-(4-chlorophenoxy)-1-[2-[(2,4-difluorophenoxy)methyl]morpholin-4-yl]ethanone
CID 46041076
1-[2-[[4-(3-bromo-2-fluorobenzoyl)morpholin-2-yl]methoxy]-5-fluorophenyl]ethanone
CID 3311022
(5-bromothiophen-2-yl)-[2-[(2,5-difluorophenoxy)methyl]morpholin-4-yl]methanone
CID 3752460
[2-[(3,4-difluorophenoxy)methyl]morpholin-4-yl]-(2,4-difluorophenyl)methanone
CID 71955615
(4-chlorophenyl)-[(2S)-2-[(3-fluorophenoxy)methyl]morpholin-4-yl]methanone
CID 93336807
[2-[(4-fluorophenoxy)methyl]morpholin-4-yl]-phenylmethanone
CID 46041108
[2-[(3,4-difluorophenoxy)methyl]morpholin-4-yl]-(4-fluorophenyl)methanone
CID 42849205
(3-fluorophenyl)-[(2R)-2-(phenoxymethyl)morpholin-4-yl]methanone
CID 93327921
(2E)-1-[2-[(2-chloro-3-pyridinyl)oxymethyl]morpholin-4-yl]-2-(furan-2-yl)-2-methoxyiminoethanone
CID 74227391
1-[2-[(2-acetyl-4-fluorophenoxy)methyl]morpholine-4-carbonyl]cyclopropane-1-carboxamide
CID 3601027
1-[2-[[4-[2,5-dimethyl-1-(thiophen-2-ylmethyl)pyrrole-3-carbonyl]morpholin-2-yl]methoxy]-5-fluorophenyl]ethanone
CID 3447691

Frequently Asked Questions

What is the IUPAC name of [2-[(2,4-difluorophenoxy)methyl]morpholin-4-yl]-(furan-2-yl)methanone?
The IUPAC name of [2-[(2,4-difluorophenoxy)methyl]morpholin-4-yl]-(furan-2-yl)methanone (CID 46041071) is [2-[(2,4-difluorophenoxy)methyl]morpholin-4-yl]-(furan-2-yl)methanone.
What is the SMILES notation for [2-[(2,4-difluorophenoxy)methyl]morpholin-4-yl]-(furan-2-yl)methanone?
The canonical SMILES for [2-[(2,4-difluorophenoxy)methyl]morpholin-4-yl]-(furan-2-yl)methanone is O=C(c1ccco1)N1CCOC(COc2ccc(F)cc2F)C1.
What is the InChIKey of [2-[(2,4-difluorophenoxy)methyl]morpholin-4-yl]-(furan-2-yl)methanone?
The InChIKey is SLXCHKZLQTVUSA-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15F2NO4/c17-11-3-4-14(13(18)8-11)23-10-12-9-19(5-7-21-12)16(20)15-2-1-6-22-15/h1-4,6,8,12H,5,7,9-10H2.
What are the key properties of [2-[(2,4-difluorophenoxy)methyl]morpholin-4-yl]-(furan-2-yl)methanone?
[2-[(2,4-difluorophenoxy)methyl]morpholin-4-yl]-(furan-2-yl)methanone has a molecular weight of 323.29 g/mol, XLogP of 2.48, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [2-[(2,4-difluorophenoxy)methyl]morpholin-4-yl]-(furan-2-yl)methanone is sourced from PubChem (CID 46041071), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).