2-[[2-[2-(4-fluorophenyl)morpholin-4-yl]-2-oxoethyl]-(2-methylpropyl)amino]acetamide

C18H26FN3O3 — CID 60506939

IUPAC2-[[2-[2-(4-fluorophenyl)morpholin-4-yl]-2-oxoethyl]-(2-methylpropyl)amino]acetamide
SMILESCC(C)CN(CC(N)=O)CC(=O)N1CCOC(c2ccc(F)cc2)C1
InChIInChI=1S/C18H26FN3O3/c1-13(2)9-21(11-17(20)23)12-18(24)22-7-8-25-16(10-22)14-3-5-15(19)6-4-14/h3-6,13,16H,7-12H2,1-2H3,(H2,20,23)
InChIKeyPJVQAHIROBFACJ-UHFFFAOYSA-N
MW351.42 g/mol
LogP1.17
Rot. Bonds7

About 2-[[2-[2-(4-fluorophenyl)morpholin-4-yl]-2-oxoethyl]-(2-methylpropyl)amino]acetamide

2-[[2-[2-(4-fluorophenyl)morpholin-4-yl]-2-oxoethyl]-(2-methylpropyl)amino]acetamide (PubChem CID 60506939) has the molecular formula C18H26FN3O3 and a molecular weight of 351.42 g/mol. Its IUPAC name is 2-[[2-[2-(4-fluorophenyl)morpholin-4-yl]-2-oxoethyl]-(2-methylpropyl)amino]acetamide.

Molecular Properties

Compound Name2-[[2-[2-(4-fluorophenyl)morpholin-4-yl]-2-oxoethyl]-(2-methylpropyl)amino]acetamide
PubChem CID60506939
Molecular FormulaC18H26FN3O3
Molecular Weight351.42 g/mol
Exact Mass351.20
IUPAC Name2-[[2-[2-(4-fluorophenyl)morpholin-4-yl]-2-oxoethyl]-(2-methylpropyl)amino]acetamide
SMILESCC(C)CN(CC(N)=O)CC(=O)N1CCOC(c2ccc(F)cc2)C1
InChIInChI=1S/C18H26FN3O3/c1-13(2)9-21(11-17(20)23)12-18(24)22-7-8-25-16(10-22)14-3-5-15(19)6-4-14/h3-6,13,16H,7-12H2,1-2H3,(H2,20,23)
InChIKeyPJVQAHIROBFACJ-UHFFFAOYSA-N
XLogP1.17
TPSA75.87 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500351.42
LogP ≤ 51.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-[2-(4-fluorophenyl)morpholin-4-yl]-2-[methyl(1-phenylethyl)amino]ethanone
CID 60500482
2-chloro-1-[(2R)-2-(4-fluorophenyl)morpholin-4-yl]ethanone
CID 51889846
(2R)-2-amino-1-[2-(4-fluorophenyl)morpholin-4-yl]propan-1-one;hydrochloride
CID 119112319
3-[2-(4-fluorophenyl)morpholin-4-yl]-3-oxopropanoic acid
CID 62231452
2-(4-fluoroanilino)-1-[2-(4-fluorophenyl)morpholin-4-yl]ethanone
CID 146126544
2-bromo-1-[2-(4-fluorophenyl)morpholin-4-yl]propan-1-one
CID 107904527
N-cyclopropyl-2-[[2-[2-(4-fluorophenyl)morpholin-4-yl]-2-oxoethyl]-methylamino]acetamide
CID 87014183
(2S,3S)-2-amino-1-[2-(4-fluorophenyl)morpholin-4-yl]-3-methylpentan-1-one
CID 61165503
1-[2-(4-fluorophenyl)morpholin-4-yl]-3-methylsulfonylpropan-1-one
CID 131913070
1-[2-(4-ethylphenyl)morpholin-4-yl]-2-(4-fluorophenyl)ethanone
CID 110364011
6-amino-1-[2-(4-fluorophenyl)morpholin-4-yl]hexan-1-one
CID 60963489
2-[2-(4-fluorophenyl)morpholin-4-yl]-N-(2-methylpropyl)-N-propan-2-ylacetamide
CID 119041161

Frequently Asked Questions

What is the IUPAC name of 2-[[2-[2-(4-fluorophenyl)morpholin-4-yl]-2-oxoethyl]-(2-methylpropyl)amino]acetamide?
The IUPAC name of 2-[[2-[2-(4-fluorophenyl)morpholin-4-yl]-2-oxoethyl]-(2-methylpropyl)amino]acetamide (CID 60506939) is 2-[[2-[2-(4-fluorophenyl)morpholin-4-yl]-2-oxoethyl]-(2-methylpropyl)amino]acetamide.
What is the SMILES notation for 2-[[2-[2-(4-fluorophenyl)morpholin-4-yl]-2-oxoethyl]-(2-methylpropyl)amino]acetamide?
The canonical SMILES for 2-[[2-[2-(4-fluorophenyl)morpholin-4-yl]-2-oxoethyl]-(2-methylpropyl)amino]acetamide is CC(C)CN(CC(N)=O)CC(=O)N1CCOC(c2ccc(F)cc2)C1.
What is the InChIKey of 2-[[2-[2-(4-fluorophenyl)morpholin-4-yl]-2-oxoethyl]-(2-methylpropyl)amino]acetamide?
The InChIKey is PJVQAHIROBFACJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H26FN3O3/c1-13(2)9-21(11-17(20)23)12-18(24)22-7-8-25-16(10-22)14-3-5-15(19)6-4-14/h3-6,13,16H,7-12H2,1-2H3,(H2,20,23).
What are the key properties of 2-[[2-[2-(4-fluorophenyl)morpholin-4-yl]-2-oxoethyl]-(2-methylpropyl)amino]acetamide?
2-[[2-[2-(4-fluorophenyl)morpholin-4-yl]-2-oxoethyl]-(2-methylpropyl)amino]acetamide has a molecular weight of 351.42 g/mol, XLogP of 1.17, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[2-[2-(4-fluorophenyl)morpholin-4-yl]-2-oxoethyl]-(2-methylpropyl)amino]acetamide is sourced from PubChem (CID 60506939), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).