N-(2-chlorophenyl)-2-[(4-ethoxyphenyl)methyl-methylamino]acetamide

C18H21ClN2O2 — CID 8799254

IUPACN-(2-chlorophenyl)-2-[(4-ethoxyphenyl)methyl-methylamino]acetamide
SMILESCCOc1ccc(CN(C)CC(=O)Nc2ccccc2Cl)cc1
InChIInChI=1S/C18H21ClN2O2/c1-3-23-15-10-8-14(9-11-15)12-21(2)13-18(22)20-17-7-5-4-6-16(17)19/h4-11H,3,12-13H2,1-2H3,(H,20,22)
InChIKeyRGQOYBJGLQMAOM-UHFFFAOYSA-N
MW332.83 g/mol
LogP3.81
Rot. Bonds7

About N-(2-chlorophenyl)-2-[(4-ethoxyphenyl)methyl-methylamino]acetamide

N-(2-chlorophenyl)-2-[(4-ethoxyphenyl)methyl-methylamino]acetamide (PubChem CID 8799254) has the molecular formula C18H21ClN2O2 and a molecular weight of 332.83 g/mol. Its IUPAC name is N-(2-chlorophenyl)-2-[(4-ethoxyphenyl)methyl-methylamino]acetamide.

Molecular Properties

Compound NameN-(2-chlorophenyl)-2-[(4-ethoxyphenyl)methyl-methylamino]acetamide
PubChem CID8799254
Molecular FormulaC18H21ClN2O2
Molecular Weight332.83 g/mol
Exact Mass332.13
IUPAC NameN-(2-chlorophenyl)-2-[(4-ethoxyphenyl)methyl-methylamino]acetamide
SMILESCCOc1ccc(CN(C)CC(=O)Nc2ccccc2Cl)cc1
InChIInChI=1S/C18H21ClN2O2/c1-3-23-15-10-8-14(9-11-15)12-21(2)13-18(22)20-17-7-5-4-6-16(17)19/h4-11H,3,12-13H2,1-2H3,(H,20,22)
InChIKeyRGQOYBJGLQMAOM-UHFFFAOYSA-N
XLogP3.81
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.83
LogP ≤ 53.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-chlorophenyl)-2-[(4-methoxyphenyl)methyl-methylamino]acetamide
CID 8761356
N-(2,5-dichlorophenyl)-2-[(4-ethoxyphenyl)methyl-methylamino]acetamide
CID 8024067
N-(2-chlorophenyl)-2-[[2-[(4-ethylphenyl)methyl-methylamino]acetyl]-methylamino]acetamide
CID 27095557
N-(9,10-dioxoanthracen-1-yl)-2-[(4-ethoxyphenyl)methyl-methylamino]acetamide
CID 27204408
N-(2-chlorophenyl)-2-[[2-[[4-(difluoromethoxy)phenyl]methyl-methylamino]acetyl]-methylamino]acetamide
CID 27096760
N-(2-chlorophenyl)-2-[[2-(4-ethylphenoxy)acetyl]-methylamino]acetamide
CID 9409682
N-(2,6-dimethylphenyl)-2-[(4-ethoxyphenyl)methyl-methylamino]acetamide
CID 8799242
N-(2-chlorophenyl)-2-[(3,4-dimethoxyphenyl)methyl-methylamino]acetamide
CID 2698878
N-benzhydryl-2-[(4-ethoxyphenyl)methyl-methylamino]acetamide
CID 8024029
N-(2,3-dimethylphenyl)-2-[[2-[(4-ethoxyphenyl)methyl-methylamino]-2-oxoethyl]-methylamino]acetamide
CID 9287622
N-(2-chlorophenyl)-2-[methyl-[2-(4-sulfamoylphenoxy)ethyl]amino]acetamide
CID 38171543
ethyl N-[2-[[2-(2-chloroanilino)-2-oxoethyl]-methylamino]acetyl]carbamate
CID 9036414

Frequently Asked Questions

What is the IUPAC name of N-(2-chlorophenyl)-2-[(4-ethoxyphenyl)methyl-methylamino]acetamide?
The IUPAC name of N-(2-chlorophenyl)-2-[(4-ethoxyphenyl)methyl-methylamino]acetamide (CID 8799254) is N-(2-chlorophenyl)-2-[(4-ethoxyphenyl)methyl-methylamino]acetamide.
What is the SMILES notation for N-(2-chlorophenyl)-2-[(4-ethoxyphenyl)methyl-methylamino]acetamide?
The canonical SMILES for N-(2-chlorophenyl)-2-[(4-ethoxyphenyl)methyl-methylamino]acetamide is CCOc1ccc(CN(C)CC(=O)Nc2ccccc2Cl)cc1.
What is the InChIKey of N-(2-chlorophenyl)-2-[(4-ethoxyphenyl)methyl-methylamino]acetamide?
The InChIKey is RGQOYBJGLQMAOM-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21ClN2O2/c1-3-23-15-10-8-14(9-11-15)12-21(2)13-18(22)20-17-7-5-4-6-16(17)19/h4-11H,3,12-13H2,1-2H3,(H,20,22).
What are the key properties of N-(2-chlorophenyl)-2-[(4-ethoxyphenyl)methyl-methylamino]acetamide?
N-(2-chlorophenyl)-2-[(4-ethoxyphenyl)methyl-methylamino]acetamide has a molecular weight of 332.83 g/mol, XLogP of 3.81, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-chlorophenyl)-2-[(4-ethoxyphenyl)methyl-methylamino]acetamide is sourced from PubChem (CID 8799254), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).