2-[(3-chlorophenyl)methyl-methylamino]-N-(2-methoxyphenyl)acetamide

C17H19ClN2O2 — CID 9251272

IUPAC2-[(3-chlorophenyl)methyl-methylamino]-N-(2-methoxyphenyl)acetamide
SMILESCOc1ccccc1NC(=O)CN(C)Cc1cccc(Cl)c1
InChIInChI=1S/C17H19ClN2O2/c1-20(11-13-6-5-7-14(18)10-13)12-17(21)19-15-8-3-4-9-16(15)22-2/h3-10H,11-12H2,1-2H3,(H,19,21)
InChIKeyLTUDPVDXSFXUQG-UHFFFAOYSA-N
MW318.80 g/mol
LogP3.42
Rot. Bonds6

About 2-[(3-chlorophenyl)methyl-methylamino]-N-(2-methoxyphenyl)acetamide

2-[(3-chlorophenyl)methyl-methylamino]-N-(2-methoxyphenyl)acetamide (PubChem CID 9251272) has the molecular formula C17H19ClN2O2 and a molecular weight of 318.80 g/mol. Its IUPAC name is 2-[(3-chlorophenyl)methyl-methylamino]-N-(2-methoxyphenyl)acetamide.

Molecular Properties

Compound Name2-[(3-chlorophenyl)methyl-methylamino]-N-(2-methoxyphenyl)acetamide
PubChem CID9251272
Molecular FormulaC17H19ClN2O2
Molecular Weight318.80 g/mol
Exact Mass318.11
IUPAC Name2-[(3-chlorophenyl)methyl-methylamino]-N-(2-methoxyphenyl)acetamide
SMILESCOc1ccccc1NC(=O)CN(C)Cc1cccc(Cl)c1
InChIInChI=1S/C17H19ClN2O2/c1-20(11-13-6-5-7-14(18)10-13)12-17(21)19-15-8-3-4-9-16(15)22-2/h3-10H,11-12H2,1-2H3,(H,19,21)
InChIKeyLTUDPVDXSFXUQG-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

2-[(3-chlorophenyl)methyl-methylamino]-N-(2,4-dimethoxyphenyl)acetamide
CID 9251366
N-(4-chloro-2-methoxy-5-methylphenyl)-2-[(3-chlorophenyl)methyl-methylamino]acetamide
CID 27249569
2-[(3-chlorophenyl)methyl-methylamino]-N-(2-ethylphenyl)acetamide
CID 26510093
N-(2-chlorophenyl)-2-[(3,4-dimethoxyphenyl)methyl-methylamino]acetamide
CID 2698878
N-(3-chlorophenyl)-2-[(3-chlorophenyl)methyl-methylamino]acetamide
CID 9251258
2-[(3-chlorophenyl)methyl-methylamino]-N-(4-fluorophenyl)acetamide
CID 9251256
2-[[2-(5-chloro-2-methoxyanilino)-2-oxoethyl]-methylamino]-N-(2-ethoxyphenyl)acetamide
CID 9222402
N-(2-methoxy-5-methylphenyl)-2-[(3-methoxyphenyl)methyl-methylamino]acetamide
CID 8002693
N-[2-(2-amino-2-oxoethyl)sulfanylphenyl]-2-[(3-chlorophenyl)methyl-methylamino]acetamide
CID 9041843
N-(5-chloro-2-methoxyphenyl)-2-[[2-[(3-fluorophenyl)methyl-methylamino]-2-oxoethyl]-methylamino]acetamide
CID 9222317
N-(5-chloro-2-fluorophenyl)-2-[(3-fluoro-4-methoxyphenyl)methyl-methylamino]acetamide
CID 9432683
2-[(3,4-dimethoxyphenyl)methyl-methylamino]-N-naphthalen-1-ylacetamide
CID 16555072

Frequently Asked Questions

What is the IUPAC name of 2-[(3-chlorophenyl)methyl-methylamino]-N-(2-methoxyphenyl)acetamide?
The IUPAC name of 2-[(3-chlorophenyl)methyl-methylamino]-N-(2-methoxyphenyl)acetamide (CID 9251272) is 2-[(3-chlorophenyl)methyl-methylamino]-N-(2-methoxyphenyl)acetamide.
What is the SMILES notation for 2-[(3-chlorophenyl)methyl-methylamino]-N-(2-methoxyphenyl)acetamide?
The canonical SMILES for 2-[(3-chlorophenyl)methyl-methylamino]-N-(2-methoxyphenyl)acetamide is COc1ccccc1NC(=O)CN(C)Cc1cccc(Cl)c1.
What is the InChIKey of 2-[(3-chlorophenyl)methyl-methylamino]-N-(2-methoxyphenyl)acetamide?
The InChIKey is LTUDPVDXSFXUQG-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19ClN2O2/c1-20(11-13-6-5-7-14(18)10-13)12-17(21)19-15-8-3-4-9-16(15)22-2/h3-10H,11-12H2,1-2H3,(H,19,21).
What are the key properties of 2-[(3-chlorophenyl)methyl-methylamino]-N-(2-methoxyphenyl)acetamide?
2-[(3-chlorophenyl)methyl-methylamino]-N-(2-methoxyphenyl)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 2-[(3-chlorophenyl)methyl-methylamino]-N-(2-methoxyphenyl)acetamide is sourced from PubChem (CID 9251272), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).