N-cyclopropyl-2-[[2-[2-(4-fluorophenyl)morpholin-4-yl]-2-oxoethyl]-methylamino]acetamide

C18H24FN3O3 — CID 87014183

IUPACN-cyclopropyl-2-[[2-[2-(4-fluorophenyl)morpholin-4-yl]-2-oxoethyl]-methylamino]acetamide
SMILESCN(CC(=O)NC1CC1)CC(=O)N1CCOC(c2ccc(F)cc2)C1
InChIInChI=1S/C18H24FN3O3/c1-21(11-17(23)20-15-6-7-15)12-18(24)22-8-9-25-16(10-22)13-2-4-14(19)5-3-13/h2-5,15-16H,6-12H2,1H3,(H,20,23)
InChIKeyHGWIKDZXNWDRLC-UHFFFAOYSA-N
MW349.41 g/mol
LogP0.94
Rot. Bonds6

About N-cyclopropyl-2-[[2-[2-(4-fluorophenyl)morpholin-4-yl]-2-oxoethyl]-methylamino]acetamide

N-cyclopropyl-2-[[2-[2-(4-fluorophenyl)morpholin-4-yl]-2-oxoethyl]-methylamino]acetamide (PubChem CID 87014183) has the molecular formula C18H24FN3O3 and a molecular weight of 349.41 g/mol. Its IUPAC name is N-cyclopropyl-2-[[2-[2-(4-fluorophenyl)morpholin-4-yl]-2-oxoethyl]-methylamino]acetamide.

Molecular Properties

Compound NameN-cyclopropyl-2-[[2-[2-(4-fluorophenyl)morpholin-4-yl]-2-oxoethyl]-methylamino]acetamide
PubChem CID87014183
Molecular FormulaC18H24FN3O3
Molecular Weight349.41 g/mol
Exact Mass349.18
IUPAC NameN-cyclopropyl-2-[[2-[2-(4-fluorophenyl)morpholin-4-yl]-2-oxoethyl]-methylamino]acetamide
SMILESCN(CC(=O)NC1CC1)CC(=O)N1CCOC(c2ccc(F)cc2)C1
InChIInChI=1S/C18H24FN3O3/c1-21(11-17(23)20-15-6-7-15)12-18(24)22-8-9-25-16(10-22)13-2-4-14(19)5-3-13/h2-5,15-16H,6-12H2,1H3,(H,20,23)
InChIKeyHGWIKDZXNWDRLC-UHFFFAOYSA-N
XLogP0.94
TPSA61.88 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500349.41
LogP ≤ 50.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-(cyclopropylamino)-1-[2-(4-fluorophenyl)morpholin-4-yl]propan-1-one
CID 60964272
3-[2-(4-fluorophenyl)morpholin-4-yl]-3-oxopropanoic acid
CID 62231452
1-[2-(4-fluorophenyl)morpholin-4-yl]-2-[methyl(1-phenylethyl)amino]ethanone
CID 60500482
methyl (2S)-2-(4-fluorophenyl)morpholine-4-carboxylate
CID 67353366
2-chloro-1-[(2R)-2-(4-fluorophenyl)morpholin-4-yl]ethanone
CID 51889846
2-cyclopentyl-1-[(2S)-2-(4-fluorophenyl)morpholin-4-yl]ethanone
CID 94823425
2-(4-fluoroanilino)-1-[2-(4-fluorophenyl)morpholin-4-yl]ethanone
CID 146126544
2-[[2-[2-(4-fluorophenyl)morpholin-4-yl]-2-oxoethyl]-(2-methylpropyl)amino]acetamide
CID 60506939
1-[(2S)-2-(4-chlorophenyl)morpholin-4-yl]-2-(dimethylamino)ethanone
CID 95205970
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

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-2-[[2-[2-(4-fluorophenyl)morpholin-4-yl]-2-oxoethyl]-methylamino]acetamide?
The IUPAC name of N-cyclopropyl-2-[[2-[2-(4-fluorophenyl)morpholin-4-yl]-2-oxoethyl]-methylamino]acetamide (CID 87014183) is N-cyclopropyl-2-[[2-[2-(4-fluorophenyl)morpholin-4-yl]-2-oxoethyl]-methylamino]acetamide.
What is the SMILES notation for N-cyclopropyl-2-[[2-[2-(4-fluorophenyl)morpholin-4-yl]-2-oxoethyl]-methylamino]acetamide?
The canonical SMILES for N-cyclopropyl-2-[[2-[2-(4-fluorophenyl)morpholin-4-yl]-2-oxoethyl]-methylamino]acetamide is CN(CC(=O)NC1CC1)CC(=O)N1CCOC(c2ccc(F)cc2)C1.
What is the InChIKey of N-cyclopropyl-2-[[2-[2-(4-fluorophenyl)morpholin-4-yl]-2-oxoethyl]-methylamino]acetamide?
The InChIKey is HGWIKDZXNWDRLC-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24FN3O3/c1-21(11-17(23)20-15-6-7-15)12-18(24)22-8-9-25-16(10-22)13-2-4-14(19)5-3-13/h2-5,15-16H,6-12H2,1H3,(H,20,23).
What are the key properties of N-cyclopropyl-2-[[2-[2-(4-fluorophenyl)morpholin-4-yl]-2-oxoethyl]-methylamino]acetamide?
N-cyclopropyl-2-[[2-[2-(4-fluorophenyl)morpholin-4-yl]-2-oxoethyl]-methylamino]acetamide has a molecular weight of 349.41 g/mol, XLogP of 0.94, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-2-[[2-[2-(4-fluorophenyl)morpholin-4-yl]-2-oxoethyl]-methylamino]acetamide is sourced from PubChem (CID 87014183), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).