N-(benzylcarbamoyl)-2-[(4-methoxyphenyl)methyl-methylamino]acetamide

C19H23N3O3 — CID 27197304

IUPACN-(benzylcarbamoyl)-2-[(4-methoxyphenyl)methyl-methylamino]acetamide
SMILESCOc1ccc(CN(C)CC(=O)NC(=O)NCc2ccccc2)cc1
InChIInChI=1S/C19H23N3O3/c1-22(13-16-8-10-17(25-2)11-9-16)14-18(23)21-19(24)20-12-15-6-4-3-5-7-15/h3-11H,12-14H2,1-2H3,(H2,20,21,23,24)
InChIKeyMUBZKAKHMAOJST-UHFFFAOYSA-N
MW341.41 g/mol
LogP2.15
Rot. Bonds7

About N-(benzylcarbamoyl)-2-[(4-methoxyphenyl)methyl-methylamino]acetamide

N-(benzylcarbamoyl)-2-[(4-methoxyphenyl)methyl-methylamino]acetamide (PubChem CID 27197304) has the molecular formula C19H23N3O3 and a molecular weight of 341.41 g/mol. Its IUPAC name is N-(benzylcarbamoyl)-2-[(4-methoxyphenyl)methyl-methylamino]acetamide.

Molecular Properties

Compound NameN-(benzylcarbamoyl)-2-[(4-methoxyphenyl)methyl-methylamino]acetamide
PubChem CID27197304
Molecular FormulaC19H23N3O3
Molecular Weight341.41 g/mol
Exact Mass341.17
IUPAC NameN-(benzylcarbamoyl)-2-[(4-methoxyphenyl)methyl-methylamino]acetamide
SMILESCOc1ccc(CN(C)CC(=O)NC(=O)NCc2ccccc2)cc1
InChIInChI=1S/C19H23N3O3/c1-22(13-16-8-10-17(25-2)11-9-16)14-18(23)21-19(24)20-12-15-6-4-3-5-7-15/h3-11H,12-14H2,1-2H3,(H2,20,21,23,24)
InChIKeyMUBZKAKHMAOJST-UHFFFAOYSA-N
XLogP2.15
TPSA70.67 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.41
LogP ≤ 52.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(benzylcarbamoyl)-2-[(2,4-dimethoxyphenyl)methyl-methylamino]acetamide
CID 2698946
N-(benzylcarbamoyl)-2-[methyl-[[4-(trifluoromethyl)phenyl]methyl]amino]acetamide
CID 27242893
3-[[2-(benzylcarbamoylamino)-2-oxoethyl]-methylamino]propanoic acid
CID 119912328
N-(benzylcarbamoyl)-2-[[2-(dimethylamino)-2-oxoethyl]-methylamino]acetamide
CID 18196365
N-(benzylcarbamoyl)-2-[methyl-[2-(4-methylphenoxy)ethyl]amino]acetamide
CID 26429400
methyl N-[2-[benzyl(methyl)amino]acetyl]carbamate
CID 8900979
2-[benzyl(methyl)amino]-N-[2-hydroxy-2-(4-methoxyphenyl)ethyl]acetamide
CID 110908744
2-[acetyl-[(4-methoxyphenyl)methyl]amino]-N-benzylacetamide
CID 113163044
N-[[(2R)-butan-2-yl]carbamoyl]-2-[(4-methoxyphenyl)methyl-methylamino]acetamide
CID 8761110
N-benzyl-2-(4-methoxyphenyl)acetamide
CID 795936
N-[2-(4-methoxyphenyl)ethyl]-2-[(4-methoxyphenyl)methyl-methylamino]acetamide
CID 8761409
2-[(3-methoxyphenyl)methyl-methylamino]-N-(2-methylpropylcarbamoyl)acetamide
CID 8780580

Frequently Asked Questions

What is the IUPAC name of N-(benzylcarbamoyl)-2-[(4-methoxyphenyl)methyl-methylamino]acetamide?
The IUPAC name of N-(benzylcarbamoyl)-2-[(4-methoxyphenyl)methyl-methylamino]acetamide (CID 27197304) is N-(benzylcarbamoyl)-2-[(4-methoxyphenyl)methyl-methylamino]acetamide.
What is the SMILES notation for N-(benzylcarbamoyl)-2-[(4-methoxyphenyl)methyl-methylamino]acetamide?
The canonical SMILES for N-(benzylcarbamoyl)-2-[(4-methoxyphenyl)methyl-methylamino]acetamide is COc1ccc(CN(C)CC(=O)NC(=O)NCc2ccccc2)cc1.
What is the InChIKey of N-(benzylcarbamoyl)-2-[(4-methoxyphenyl)methyl-methylamino]acetamide?
The InChIKey is MUBZKAKHMAOJST-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23N3O3/c1-22(13-16-8-10-17(25-2)11-9-16)14-18(23)21-19(24)20-12-15-6-4-3-5-7-15/h3-11H,12-14H2,1-2H3,(H2,20,21,23,24).
What are the key properties of N-(benzylcarbamoyl)-2-[(4-methoxyphenyl)methyl-methylamino]acetamide?
N-(benzylcarbamoyl)-2-[(4-methoxyphenyl)methyl-methylamino]acetamide has a molecular weight of 341.41 g/mol, XLogP of 2.15, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(benzylcarbamoyl)-2-[(4-methoxyphenyl)methyl-methylamino]acetamide is sourced from PubChem (CID 27197304), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).