(2-fluoro-6-methoxyphenyl)-morpholin-4-ylmethanone

C12H14FNO3 — CID 65432492

IUPAC(2-fluoro-6-methoxyphenyl)-morpholin-4-ylmethanone
SMILESCOc1cccc(F)c1C(=O)N1CCOCC1
InChIInChI=1S/C12H14FNO3/c1-16-10-4-2-3-9(13)11(10)12(15)14-5-7-17-8-6-14/h2-4H,5-8H2,1H3
InChIKeyVZHMFWZZOAGELI-UHFFFAOYSA-N
MW239.25 g/mol
LogP1.31
Rot. Bonds2

About (2-fluoro-6-methoxyphenyl)-morpholin-4-ylmethanone

(2-fluoro-6-methoxyphenyl)-morpholin-4-ylmethanone (PubChem CID 65432492) has the molecular formula C12H14FNO3 and a molecular weight of 239.25 g/mol. Its IUPAC name is (2-fluoro-6-methoxyphenyl)-morpholin-4-ylmethanone.

Molecular Properties

Compound Name(2-fluoro-6-methoxyphenyl)-morpholin-4-ylmethanone
PubChem CID65432492
Molecular FormulaC12H14FNO3
Molecular Weight239.25 g/mol
Exact Mass239.10
IUPAC Name(2-fluoro-6-methoxyphenyl)-morpholin-4-ylmethanone
SMILESCOc1cccc(F)c1C(=O)N1CCOCC1
InChIInChI=1S/C12H14FNO3/c1-16-10-4-2-3-9(13)11(10)12(15)14-5-7-17-8-6-14/h2-4H,5-8H2,1H3
InChIKeyVZHMFWZZOAGELI-UHFFFAOYSA-N
XLogP1.31
TPSA38.77 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.25
LogP ≤ 51.31
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

(2,6-difluorophenyl)-morpholin-4-ylmethanone
CID 532216
(2-methoxy-6-methylphenyl)-morpholin-4-ylmethanone
CID 131909764
(4-bromopiperidin-1-yl)-(2-fluoro-6-methoxyphenyl)methanone
CID 80662755
1-(2-fluoro-6-methoxybenzoyl)piperidine-4-carboxylic acid
CID 65432243
[4-(1-aminoethyl)piperidin-1-yl]-(2-fluoro-6-methoxyphenyl)methanone
CID 65433856
2-[4-(2-fluoro-6-methoxybenzoyl)piperazin-1-yl]acetic acid
CID 65434176
[2-(chloromethyl)morpholin-4-yl]-(2-fluoro-6-methoxyphenyl)methanone
CID 81211064
2-[4-(2-fluoro-6-methoxybenzoyl)morpholin-2-yl]acetic acid
CID 66435743
[4-(2-aminoethyl)piperidin-1-yl]-(2-fluoro-6-methoxyphenyl)methanone
CID 65435015
4-(2-fluoro-6-methoxybenzoyl)piperazine-2,6-dione
CID 66085710
[4-(2-chloro-6-fluorobenzoyl)-1,4-diazepan-1-yl]-(2,6-dimethoxyphenyl)methanone
CID 108544564
[(3R,4R)-3-fluoro-4-hydroxypyrrolidin-1-yl]-(2-fluoro-6-methoxyphenyl)methanone
CID 131889781

Frequently Asked Questions

What is the IUPAC name of (2-fluoro-6-methoxyphenyl)-morpholin-4-ylmethanone?
The IUPAC name of (2-fluoro-6-methoxyphenyl)-morpholin-4-ylmethanone (CID 65432492) is (2-fluoro-6-methoxyphenyl)-morpholin-4-ylmethanone.
What is the SMILES notation for (2-fluoro-6-methoxyphenyl)-morpholin-4-ylmethanone?
The canonical SMILES for (2-fluoro-6-methoxyphenyl)-morpholin-4-ylmethanone is COc1cccc(F)c1C(=O)N1CCOCC1.
What is the InChIKey of (2-fluoro-6-methoxyphenyl)-morpholin-4-ylmethanone?
The InChIKey is VZHMFWZZOAGELI-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14FNO3/c1-16-10-4-2-3-9(13)11(10)12(15)14-5-7-17-8-6-14/h2-4H,5-8H2,1H3.
What are the key properties of (2-fluoro-6-methoxyphenyl)-morpholin-4-ylmethanone?
(2-fluoro-6-methoxyphenyl)-morpholin-4-ylmethanone has a molecular weight of 239.25 g/mol, XLogP of 1.31, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2-fluoro-6-methoxyphenyl)-morpholin-4-ylmethanone is sourced from PubChem (CID 65432492), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).