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

C17H19ClN2O2 — CID 8761356

IUPACN-(2-chlorophenyl)-2-[(4-methoxyphenyl)methyl-methylamino]acetamide
SMILESCOc1ccc(CN(C)CC(=O)Nc2ccccc2Cl)cc1
InChIInChI=1S/C17H19ClN2O2/c1-20(11-13-7-9-14(22-2)10-8-13)12-17(21)19-16-6-4-3-5-15(16)18/h3-10H,11-12H2,1-2H3,(H,19,21)
InChIKeyZNLHVKFOXKVXAC-UHFFFAOYSA-N
MW318.80 g/mol
LogP3.42
Rot. Bonds6

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

N-(2-chlorophenyl)-2-[(4-methoxyphenyl)methyl-methylamino]acetamide (PubChem CID 8761356) has the molecular formula C17H19ClN2O2 and a molecular weight of 318.80 g/mol. Its IUPAC name is N-(2-chlorophenyl)-2-[(4-methoxyphenyl)methyl-methylamino]acetamide.

Molecular Properties

Compound NameN-(2-chlorophenyl)-2-[(4-methoxyphenyl)methyl-methylamino]acetamide
PubChem CID8761356
Molecular FormulaC17H19ClN2O2
Molecular Weight318.80 g/mol
Exact Mass318.11
IUPAC NameN-(2-chlorophenyl)-2-[(4-methoxyphenyl)methyl-methylamino]acetamide
SMILESCOc1ccc(CN(C)CC(=O)Nc2ccccc2Cl)cc1
InChIInChI=1S/C17H19ClN2O2/c1-20(11-13-7-9-14(22-2)10-8-13)12-17(21)19-16-6-4-3-5-15(16)18/h3-10H,11-12H2,1-2H3,(H,19,21)
InChIKeyZNLHVKFOXKVXAC-UHFFFAOYSA-N
XLogP3.42
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500318.80
LogP ≤ 53.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-chlorophenyl)-2-[(4-ethoxyphenyl)methyl-methylamino]acetamide
CID 8799254
N-(2-chlorophenyl)-2-[(3,4-dimethoxyphenyl)methyl-methylamino]acetamide
CID 2698878
2-[[2-[(4-methoxyphenyl)methyl-methylamino]acetyl]amino]benzamide
CID 18135121
2-[(4-methoxyphenyl)methyl-methylamino]-N-[2-(trifluoromethyl)phenyl]acetamide
CID 4883947
2-[[2-[bis(4-methoxyphenyl)methylamino]-2-oxoethyl]-methylamino]-N-(2-chlorophenyl)acetamide
CID 27637883
2-[(4-methoxyphenyl)methyl-methylamino]-N-(2,4,6-trichlorophenyl)acetamide
CID 8761436
N-(2-chlorophenyl)-2-[[2-[[4-(difluoromethoxy)phenyl]methyl-methylamino]acetyl]-methylamino]acetamide
CID 27096760
N-(2-chlorophenyl)-2-[[2-[(4-ethylphenyl)methyl-methylamino]acetyl]-methylamino]acetamide
CID 27095557
N-(5-chloro-2-fluorophenyl)-2-[(4-methoxyphenyl)methyl-methylamino]acetamide;oxalic acid
CID 17401827
N-(2-fluorophenyl)-2-[(6-methoxynaphthalen-2-yl)methyl-methylamino]acetamide
CID 9054040
N-(3-chloro-4-methylphenyl)-2-[(4-methoxyphenyl)methyl-methylamino]acetamide
CID 8761370
N'-(2-chlorophenyl)-N-[(4-methoxyphenyl)methyl]propanediamide
CID 108947071

Frequently Asked Questions

What is the IUPAC name of N-(2-chlorophenyl)-2-[(4-methoxyphenyl)methyl-methylamino]acetamide?
The IUPAC name of N-(2-chlorophenyl)-2-[(4-methoxyphenyl)methyl-methylamino]acetamide (CID 8761356) is N-(2-chlorophenyl)-2-[(4-methoxyphenyl)methyl-methylamino]acetamide.
What is the SMILES notation for N-(2-chlorophenyl)-2-[(4-methoxyphenyl)methyl-methylamino]acetamide?
The canonical SMILES for N-(2-chlorophenyl)-2-[(4-methoxyphenyl)methyl-methylamino]acetamide is COc1ccc(CN(C)CC(=O)Nc2ccccc2Cl)cc1.
What is the InChIKey of N-(2-chlorophenyl)-2-[(4-methoxyphenyl)methyl-methylamino]acetamide?
The InChIKey is ZNLHVKFOXKVXAC-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19ClN2O2/c1-20(11-13-7-9-14(22-2)10-8-13)12-17(21)19-16-6-4-3-5-15(16)18/h3-10H,11-12H2,1-2H3,(H,19,21).
What are the key properties of N-(2-chlorophenyl)-2-[(4-methoxyphenyl)methyl-methylamino]acetamide?
N-(2-chlorophenyl)-2-[(4-methoxyphenyl)methyl-methylamino]acetamide has a molecular weight of 318.80 g/mol, XLogP of 3.42, 6 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-methoxyphenyl)methyl-methylamino]acetamide is sourced from PubChem (CID 8761356), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).