2-[benzyl(1-morpholin-4-ylpropan-2-yl)amino]-N-(2,5-dimethoxyphenyl)acetamide

C24H33N3O4 — CID 56542784

IUPAC2-[benzyl(1-morpholin-4-ylpropan-2-yl)amino]-N-(2,5-dimethoxyphenyl)acetamide
SMILESCOc1ccc(OC)c(NC(=O)CN(Cc2ccccc2)C(C)CN2CCOCC2)c1
InChIInChI=1S/C24H33N3O4/c1-19(16-26-11-13-31-14-12-26)27(17-20-7-5-4-6-8-20)18-24(28)25-22-15-21(29-2)9-10-23(22)30-3/h4-10,15,19H,11-14,16-18H2,1-3H3,(H,25,28)
InChIKeyZBBOUJBSXYDZJU-UHFFFAOYSA-N
MW427.55 g/mol
LogP2.87
Rot. Bonds10

About 2-[benzyl(1-morpholin-4-ylpropan-2-yl)amino]-N-(2,5-dimethoxyphenyl)acetamide

2-[benzyl(1-morpholin-4-ylpropan-2-yl)amino]-N-(2,5-dimethoxyphenyl)acetamide (PubChem CID 56542784) has the molecular formula C24H33N3O4 and a molecular weight of 427.55 g/mol. Its IUPAC name is 2-[benzyl(1-morpholin-4-ylpropan-2-yl)amino]-N-(2,5-dimethoxyphenyl)acetamide.

Molecular Properties

Compound Name2-[benzyl(1-morpholin-4-ylpropan-2-yl)amino]-N-(2,5-dimethoxyphenyl)acetamide
PubChem CID56542784
Molecular FormulaC24H33N3O4
Molecular Weight427.55 g/mol
Exact Mass427.25
IUPAC Name2-[benzyl(1-morpholin-4-ylpropan-2-yl)amino]-N-(2,5-dimethoxyphenyl)acetamide
SMILESCOc1ccc(OC)c(NC(=O)CN(Cc2ccccc2)C(C)CN2CCOCC2)c1
InChIInChI=1S/C24H33N3O4/c1-19(16-26-11-13-31-14-12-26)27(17-20-7-5-4-6-8-20)18-24(28)25-22-15-21(29-2)9-10-23(22)30-3/h4-10,15,19H,11-14,16-18H2,1-3H3,(H,25,28)
InChIKeyZBBOUJBSXYDZJU-UHFFFAOYSA-N
XLogP2.87
TPSA63.27 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds10
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500427.55
LogP ≤ 52.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

2-[benzyl(1-morpholin-4-ylpropan-2-yl)amino]-N-[2-(4-methoxyphenyl)ethyl]acetamide
CID 56570050
2-[benzyl(1-morpholin-4-ylpropan-2-yl)amino]-N-(3,4-dimethylphenyl)acetamide
CID 56570018
2-[benzyl(1-morpholin-4-ylpropan-2-yl)amino]-N-(1-phenylethyl)acetamide
CID 56542719
2-[benzyl(1-morpholin-4-ylpropan-2-yl)amino]-N-(4-methyl-3-nitrophenyl)acetamide
CID 56542755
1-[benzyl(1-morpholin-4-ylpropan-2-yl)amino]-3-(4-methoxyphenoxy)propan-2-ol
CID 56570250
N-(2,5-dimethoxyphenyl)-2-(2-morpholin-4-ylethylsulfanyl)acetamide
CID 134064364
N-(2,5-dimethoxyphenyl)-3-(morpholin-4-ylmethyl)benzamide
CID 28572616
N-(5-acetamido-2-methoxyphenyl)-2-[benzyl(1-cyclopropylethyl)amino]acetamide
CID 46402737
N-(5-ethyl-2-methoxyphenyl)-2-morpholin-4-ylacetamide
CID 154733696
N-(2,5-dimethoxyphenyl)-2-[(4-ethylphenyl)methyl-methylamino]acetamide
CID 8907896
N-(2,5-dimethoxyphenyl)-4-(morpholin-4-ylmethyl)benzamide
CID 1106324
2-(N-acetyl-2-ethylanilino)-N-(2,5-dimethoxyphenyl)acetamide
CID 113169147

Frequently Asked Questions

What is the IUPAC name of 2-[benzyl(1-morpholin-4-ylpropan-2-yl)amino]-N-(2,5-dimethoxyphenyl)acetamide?
The IUPAC name of 2-[benzyl(1-morpholin-4-ylpropan-2-yl)amino]-N-(2,5-dimethoxyphenyl)acetamide (CID 56542784) is 2-[benzyl(1-morpholin-4-ylpropan-2-yl)amino]-N-(2,5-dimethoxyphenyl)acetamide.
What is the SMILES notation for 2-[benzyl(1-morpholin-4-ylpropan-2-yl)amino]-N-(2,5-dimethoxyphenyl)acetamide?
The canonical SMILES for 2-[benzyl(1-morpholin-4-ylpropan-2-yl)amino]-N-(2,5-dimethoxyphenyl)acetamide is COc1ccc(OC)c(NC(=O)CN(Cc2ccccc2)C(C)CN2CCOCC2)c1.
What is the InChIKey of 2-[benzyl(1-morpholin-4-ylpropan-2-yl)amino]-N-(2,5-dimethoxyphenyl)acetamide?
The InChIKey is ZBBOUJBSXYDZJU-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H33N3O4/c1-19(16-26-11-13-31-14-12-26)27(17-20-7-5-4-6-8-20)18-24(28)25-22-15-21(29-2)9-10-23(22)30-3/h4-10,15,19H,11-14,16-18H2,1-3H3,(H,25,28).
What are the key properties of 2-[benzyl(1-morpholin-4-ylpropan-2-yl)amino]-N-(2,5-dimethoxyphenyl)acetamide?
2-[benzyl(1-morpholin-4-ylpropan-2-yl)amino]-N-(2,5-dimethoxyphenyl)acetamide has a molecular weight of 427.55 g/mol, XLogP of 2.87, 10 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[benzyl(1-morpholin-4-ylpropan-2-yl)amino]-N-(2,5-dimethoxyphenyl)acetamide is sourced from PubChem (CID 56542784), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).