2-(2-chlorophenoxy)-N-[2-(dimethylamino)-2-(4-methylphenyl)ethyl]acetamide

C19H23ClN2O2 — CID 45155076

IUPAC2-(2-chlorophenoxy)-N-[2-(dimethylamino)-2-(4-methylphenyl)ethyl]acetamide
SMILESCc1ccc(C(CNC(=O)COc2ccccc2Cl)N(C)C)cc1
InChIInChI=1S/C19H23ClN2O2/c1-14-8-10-15(11-9-14)17(22(2)3)12-21-19(23)13-24-18-7-5-4-6-16(18)20/h4-11,17H,12-13H2,1-3H3,(H,21,23)
InChIKeyUPNRZKXMRWKVKA-UHFFFAOYSA-N
MW346.86 g/mol
LogP3.45
Rot. Bonds7

About 2-(2-chlorophenoxy)-N-[2-(dimethylamino)-2-(4-methylphenyl)ethyl]acetamide

2-(2-chlorophenoxy)-N-[2-(dimethylamino)-2-(4-methylphenyl)ethyl]acetamide (PubChem CID 45155076) has the molecular formula C19H23ClN2O2 and a molecular weight of 346.86 g/mol. Its IUPAC name is 2-(2-chlorophenoxy)-N-[2-(dimethylamino)-2-(4-methylphenyl)ethyl]acetamide.

Molecular Properties

Compound Name2-(2-chlorophenoxy)-N-[2-(dimethylamino)-2-(4-methylphenyl)ethyl]acetamide
PubChem CID45155076
Molecular FormulaC19H23ClN2O2
Molecular Weight346.86 g/mol
Exact Mass346.14
IUPAC Name2-(2-chlorophenoxy)-N-[2-(dimethylamino)-2-(4-methylphenyl)ethyl]acetamide
SMILESCc1ccc(C(CNC(=O)COc2ccccc2Cl)N(C)C)cc1
InChIInChI=1S/C19H23ClN2O2/c1-14-8-10-15(11-9-14)17(22(2)3)12-21-19(23)13-24-18-7-5-4-6-16(18)20/h4-11,17H,12-13H2,1-3H3,(H,21,23)
InChIKeyUPNRZKXMRWKVKA-UHFFFAOYSA-N
XLogP3.45
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500346.86
LogP ≤ 53.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-(dimethylamino)-2-(4-methylphenyl)ethyl]-2-(2,3-dimethylphenoxy)acetamide
CID 45155077
N-[(2S)-2-(dimethylamino)-2-(4-methylphenyl)ethyl]-2-phenoxyacetamide
CID 41318293
2-(2-chlorophenoxy)-N-[2-(dimethylamino)-2-thiophen-2-ylethyl]acetamide
CID 18161769
N-[(2R)-2-(dimethylamino)-2-[4-(dimethylamino)phenyl]ethyl]-2-(2-methylphenoxy)acetamide
CID 7496094
N-[2-(dimethylamino)-2-phenylethyl]-2-(2-ethoxyphenoxy)acetamide
CID 42893424
2-(2-chlorophenoxy)-N-[2-(hydroxymethyl)-3-(4-methylphenyl)propyl]acetamide
CID 119046862
N-[(2S)-2-(dimethylamino)-2-(4-methylphenyl)ethyl]-2-(4-methoxyphenoxy)acetamide
CID 41318325
N-[(2R)-2-(dimethylamino)-2-phenylethyl]-2-(2-fluorophenoxy)acetamide
CID 41318277
N-[2-(dimethylamino)-2-(4-ethoxyphenyl)ethyl]-2-(4-methylphenoxy)acetamide
CID 45001670
2-(2-chlorophenoxy)-N-(3-methyl-2-propan-2-ylbutyl)acetamide
CID 102914944
N-[2-(3,4-dimethoxyphenyl)-2-(dimethylamino)ethyl]-2-(2-methoxyphenoxy)acetamide
CID 2998274
N-[2-(3-chlorophenyl)-2-(dimethylamino)ethyl]-2-(4-methylphenoxy)acetamide
CID 112506773

Frequently Asked Questions

What is the IUPAC name of 2-(2-chlorophenoxy)-N-[2-(dimethylamino)-2-(4-methylphenyl)ethyl]acetamide?
The IUPAC name of 2-(2-chlorophenoxy)-N-[2-(dimethylamino)-2-(4-methylphenyl)ethyl]acetamide (CID 45155076) is 2-(2-chlorophenoxy)-N-[2-(dimethylamino)-2-(4-methylphenyl)ethyl]acetamide.
What is the SMILES notation for 2-(2-chlorophenoxy)-N-[2-(dimethylamino)-2-(4-methylphenyl)ethyl]acetamide?
The canonical SMILES for 2-(2-chlorophenoxy)-N-[2-(dimethylamino)-2-(4-methylphenyl)ethyl]acetamide is Cc1ccc(C(CNC(=O)COc2ccccc2Cl)N(C)C)cc1.
What is the InChIKey of 2-(2-chlorophenoxy)-N-[2-(dimethylamino)-2-(4-methylphenyl)ethyl]acetamide?
The InChIKey is UPNRZKXMRWKVKA-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23ClN2O2/c1-14-8-10-15(11-9-14)17(22(2)3)12-21-19(23)13-24-18-7-5-4-6-16(18)20/h4-11,17H,12-13H2,1-3H3,(H,21,23).
What are the key properties of 2-(2-chlorophenoxy)-N-[2-(dimethylamino)-2-(4-methylphenyl)ethyl]acetamide?
2-(2-chlorophenoxy)-N-[2-(dimethylamino)-2-(4-methylphenyl)ethyl]acetamide has a molecular weight of 346.86 g/mol, XLogP of 3.45, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-chlorophenoxy)-N-[2-(dimethylamino)-2-(4-methylphenyl)ethyl]acetamide is sourced from PubChem (CID 45155076), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).