(3-fluorophenyl)-[4-[[2-(morpholine-4-carbonyl)phenoxy]methyl]piperidin-1-yl]methanone

C24H27FN2O4 — CID 50846441

IUPAC(3-fluorophenyl)-[4-[[2-(morpholine-4-carbonyl)phenoxy]methyl]piperidin-1-yl]methanone
SMILESO=C(c1cccc(F)c1)N1CCC(COc2ccccc2C(=O)N2CCOCC2)CC1
InChIInChI=1S/C24H27FN2O4/c25-20-5-3-4-19(16-20)23(28)26-10-8-18(9-11-26)17-31-22-7-2-1-6-21(22)24(29)27-12-14-30-15-13-27/h1-7,16,18H,8-15,17H2
InChIKeyLIPURWQVEBBYTO-UHFFFAOYSA-N
MW426.49 g/mol
LogP3.23
Rot. Bonds5

About (3-fluorophenyl)-[4-[[2-(morpholine-4-carbonyl)phenoxy]methyl]piperidin-1-yl]methanone

(3-fluorophenyl)-[4-[[2-(morpholine-4-carbonyl)phenoxy]methyl]piperidin-1-yl]methanone (PubChem CID 50846441) has the molecular formula C24H27FN2O4 and a molecular weight of 426.49 g/mol. Its IUPAC name is (3-fluorophenyl)-[4-[[2-(morpholine-4-carbonyl)phenoxy]methyl]piperidin-1-yl]methanone.

Molecular Properties

Compound Name(3-fluorophenyl)-[4-[[2-(morpholine-4-carbonyl)phenoxy]methyl]piperidin-1-yl]methanone
PubChem CID50846441
Molecular FormulaC24H27FN2O4
Molecular Weight426.49 g/mol
Exact Mass426.20
IUPAC Name(3-fluorophenyl)-[4-[[2-(morpholine-4-carbonyl)phenoxy]methyl]piperidin-1-yl]methanone
SMILESO=C(c1cccc(F)c1)N1CCC(COc2ccccc2C(=O)N2CCOCC2)CC1
InChIInChI=1S/C24H27FN2O4/c25-20-5-3-4-19(16-20)23(28)26-10-8-18(9-11-26)17-31-22-7-2-1-6-21(22)24(29)27-12-14-30-15-13-27/h1-7,16,18H,8-15,17H2
InChIKeyLIPURWQVEBBYTO-UHFFFAOYSA-N
XLogP3.23
TPSA59.08 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500426.49
LogP ≤ 53.23
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze (3-fluorophenyl)-[4-[[2-(morpholine-4-carbonyl)phenoxy]methyl]piperidin-1-yl]methanone with MolForge

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Related Compounds

[2-[[1-(2-chlorobenzoyl)piperidin-4-yl]methoxy]phenyl]-morpholin-4-ylmethanone
CID 50846409
1-[4-[[2-(morpholine-4-carbonyl)phenoxy]methyl]piperidin-1-yl]prop-2-en-1-one
CID 50846376
[4-[[1-(2,4-difluorobenzoyl)piperidin-4-yl]methoxy]phenyl]-morpholin-4-ylmethanone
CID 53150445
(3-fluorophenyl)-[4-(2-morpholin-4-ylethyl)piperazin-1-yl]methanone
CID 113073665
[2-(cyclopropylmethoxy)phenyl]-[4-(ethylaminomethyl)piperidin-1-yl]methanone
CID 119646664
3-fluoro-N-[2-(morpholine-4-carbonyl)phenyl]benzamide
CID 727290
[4-[[1-(3-fluoro-4-methylbenzoyl)piperidin-4-yl]methoxy]phenyl]-morpholin-4-ylmethanone
CID 53150447
2-[4-(3-fluorobenzoyl)piperazine-1-carbonyl]benzoic acid
CID 113083234
[2-(cyclopropylmethoxy)phenyl]-[4-(cyclopropylmethylamino)piperidin-1-yl]methanone;hydrochloride
CID 119623869
2-fluoro-6-[[1-(3-iodobenzoyl)piperidin-4-yl]methoxy]benzonitrile
CID 66924441
(3-fluorophenyl)-[3-(phenoxymethyl)piperidin-1-yl]methanone
CID 110638403
[4-[(3,5-dimethoxyphenyl)methoxymethyl]piperidin-1-yl]-(3-fluorophenyl)methanone
CID 71784802

Frequently Asked Questions

What is the IUPAC name of (3-fluorophenyl)-[4-[[2-(morpholine-4-carbonyl)phenoxy]methyl]piperidin-1-yl]methanone?
The IUPAC name of (3-fluorophenyl)-[4-[[2-(morpholine-4-carbonyl)phenoxy]methyl]piperidin-1-yl]methanone (CID 50846441) is (3-fluorophenyl)-[4-[[2-(morpholine-4-carbonyl)phenoxy]methyl]piperidin-1-yl]methanone.
What is the SMILES notation for (3-fluorophenyl)-[4-[[2-(morpholine-4-carbonyl)phenoxy]methyl]piperidin-1-yl]methanone?
The canonical SMILES for (3-fluorophenyl)-[4-[[2-(morpholine-4-carbonyl)phenoxy]methyl]piperidin-1-yl]methanone is O=C(c1cccc(F)c1)N1CCC(COc2ccccc2C(=O)N2CCOCC2)CC1.
What is the InChIKey of (3-fluorophenyl)-[4-[[2-(morpholine-4-carbonyl)phenoxy]methyl]piperidin-1-yl]methanone?
The InChIKey is LIPURWQVEBBYTO-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H27FN2O4/c25-20-5-3-4-19(16-20)23(28)26-10-8-18(9-11-26)17-31-22-7-2-1-6-21(22)24(29)27-12-14-30-15-13-27/h1-7,16,18H,8-15,17H2.
What are the key properties of (3-fluorophenyl)-[4-[[2-(morpholine-4-carbonyl)phenoxy]methyl]piperidin-1-yl]methanone?
(3-fluorophenyl)-[4-[[2-(morpholine-4-carbonyl)phenoxy]methyl]piperidin-1-yl]methanone has a molecular weight of 426.49 g/mol, XLogP of 3.23, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (3-fluorophenyl)-[4-[[2-(morpholine-4-carbonyl)phenoxy]methyl]piperidin-1-yl]methanone is sourced from PubChem (CID 50846441), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).