2-[4-[2-[benzyl(1-morpholin-4-ylpropan-2-yl)amino]-2-oxoethoxy]phenyl]acetamide

C24H31N3O4 — CID 56500698

IUPAC2-[4-[2-[benzyl(1-morpholin-4-ylpropan-2-yl)amino]-2-oxoethoxy]phenyl]acetamide
SMILESCC(CN1CCOCC1)N(Cc1ccccc1)C(=O)COc1ccc(CC(N)=O)cc1
InChIInChI=1S/C24H31N3O4/c1-19(16-26-11-13-30-14-12-26)27(17-21-5-3-2-4-6-21)24(29)18-31-22-9-7-20(8-10-22)15-23(25)28/h2-10,19H,11-18H2,1H3,(H2,25,28)
InChIKeyOFBLFGBNAKPUQJ-UHFFFAOYSA-N
MW425.53 g/mol
LogP1.84
Rot. Bonds10

About 2-[4-[2-[benzyl(1-morpholin-4-ylpropan-2-yl)amino]-2-oxoethoxy]phenyl]acetamide

2-[4-[2-[benzyl(1-morpholin-4-ylpropan-2-yl)amino]-2-oxoethoxy]phenyl]acetamide (PubChem CID 56500698) has the molecular formula C24H31N3O4 and a molecular weight of 425.53 g/mol. Its IUPAC name is 2-[4-[2-[benzyl(1-morpholin-4-ylpropan-2-yl)amino]-2-oxoethoxy]phenyl]acetamide.

Molecular Properties

Compound Name2-[4-[2-[benzyl(1-morpholin-4-ylpropan-2-yl)amino]-2-oxoethoxy]phenyl]acetamide
PubChem CID56500698
Molecular FormulaC24H31N3O4
Molecular Weight425.53 g/mol
Exact Mass425.23
IUPAC Name2-[4-[2-[benzyl(1-morpholin-4-ylpropan-2-yl)amino]-2-oxoethoxy]phenyl]acetamide
SMILESCC(CN1CCOCC1)N(Cc1ccccc1)C(=O)COc1ccc(CC(N)=O)cc1
InChIInChI=1S/C24H31N3O4/c1-19(16-26-11-13-30-14-12-26)27(17-21-5-3-2-4-6-21)24(29)18-31-22-9-7-20(8-10-22)15-23(25)28/h2-10,19H,11-18H2,1H3,(H2,25,28)
InChIKeyOFBLFGBNAKPUQJ-UHFFFAOYSA-N
XLogP1.84
TPSA85.10 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds10
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500425.53
LogP ≤ 51.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-benzyl-2-(4-ethoxyphenyl)-N-(1-morpholin-4-ylpropan-2-yl)acetamide
CID 56500857
2-(4-aminophenyl)-N-benzyl-N-(1-morpholin-4-ylpropan-2-yl)acetamide;dihydrochloride
CID 119877064
N-benzyl-N-(1-morpholin-4-ylpropan-2-yl)-2-(4-sulfamoylphenyl)acetamide
CID 56581067
N-benzyl-N-(1-morpholin-4-ylpropan-2-yl)-2-[4-(trifluoromethyl)phenyl]acetamide
CID 56500713
N-benzyl-2-[(2-chlorophenyl)methoxy]-N-(1-morpholin-4-ylpropan-2-yl)acetamide
CID 56501629
N-benzyl-4-(methylamino)-N-(1-morpholin-4-ylpropan-2-yl)butanamide
CID 119877069
N-benzyl-N-(1-morpholin-4-ylpropan-2-yl)-2-phenoxypropanamide
CID 56500998
2-amino-N-benzyl-N-(1-morpholin-4-ylpropan-2-yl)pentanamide
CID 119877071
2-[4-[(2R)-2-hydroxy-3-morpholin-4-ylpropoxy]phenyl]acetamide
CID 7100169
N-benzyl-N-(1-morpholin-4-ylpropan-2-yl)-2-(2-phenyl-1,3-oxazol-4-yl)acetamide
CID 56501375
N-benzyl-5-(3-methylphenoxy)-N-(1-morpholin-4-ylpropan-2-yl)pentanamide
CID 56501893
N-benzyl-2-bromo-5-methoxy-N-(1-morpholin-4-ylpropan-2-yl)benzamide
CID 56500983

Frequently Asked Questions

What is the IUPAC name of 2-[4-[2-[benzyl(1-morpholin-4-ylpropan-2-yl)amino]-2-oxoethoxy]phenyl]acetamide?
The IUPAC name of 2-[4-[2-[benzyl(1-morpholin-4-ylpropan-2-yl)amino]-2-oxoethoxy]phenyl]acetamide (CID 56500698) is 2-[4-[2-[benzyl(1-morpholin-4-ylpropan-2-yl)amino]-2-oxoethoxy]phenyl]acetamide.
What is the SMILES notation for 2-[4-[2-[benzyl(1-morpholin-4-ylpropan-2-yl)amino]-2-oxoethoxy]phenyl]acetamide?
The canonical SMILES for 2-[4-[2-[benzyl(1-morpholin-4-ylpropan-2-yl)amino]-2-oxoethoxy]phenyl]acetamide is CC(CN1CCOCC1)N(Cc1ccccc1)C(=O)COc1ccc(CC(N)=O)cc1.
What is the InChIKey of 2-[4-[2-[benzyl(1-morpholin-4-ylpropan-2-yl)amino]-2-oxoethoxy]phenyl]acetamide?
The InChIKey is OFBLFGBNAKPUQJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H31N3O4/c1-19(16-26-11-13-30-14-12-26)27(17-21-5-3-2-4-6-21)24(29)18-31-22-9-7-20(8-10-22)15-23(25)28/h2-10,19H,11-18H2,1H3,(H2,25,28).
What are the key properties of 2-[4-[2-[benzyl(1-morpholin-4-ylpropan-2-yl)amino]-2-oxoethoxy]phenyl]acetamide?
2-[4-[2-[benzyl(1-morpholin-4-ylpropan-2-yl)amino]-2-oxoethoxy]phenyl]acetamide has a molecular weight of 425.53 g/mol, XLogP of 1.84, 10 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-[2-[benzyl(1-morpholin-4-ylpropan-2-yl)amino]-2-oxoethoxy]phenyl]acetamide is sourced from PubChem (CID 56500698), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).