2-(3-chlorophenoxy)-N-ethyl-N-(3-methylphenyl)acetamide

C17H18ClNO2 — CID 112977302

IUPAC2-(3-chlorophenoxy)-N-ethyl-N-(3-methylphenyl)acetamide
SMILESCCN(C(=O)COc1cccc(Cl)c1)c1cccc(C)c1
InChIInChI=1S/C17H18ClNO2/c1-3-19(15-8-4-6-13(2)10-15)17(20)12-21-16-9-5-7-14(18)11-16/h4-11H,3,12H2,1-2H3
InChIKeyNRGIEWHGZDHDNW-UHFFFAOYSA-N
MW303.79 g/mol
LogP4.08
Rot. Bonds5

About 2-(3-chlorophenoxy)-N-ethyl-N-(3-methylphenyl)acetamide

2-(3-chlorophenoxy)-N-ethyl-N-(3-methylphenyl)acetamide (PubChem CID 112977302) has the molecular formula C17H18ClNO2 and a molecular weight of 303.79 g/mol. Its IUPAC name is 2-(3-chlorophenoxy)-N-ethyl-N-(3-methylphenyl)acetamide.

Molecular Properties

Compound Name2-(3-chlorophenoxy)-N-ethyl-N-(3-methylphenyl)acetamide
PubChem CID112977302
Molecular FormulaC17H18ClNO2
Molecular Weight303.79 g/mol
Exact Mass303.10
IUPAC Name2-(3-chlorophenoxy)-N-ethyl-N-(3-methylphenyl)acetamide
SMILESCCN(C(=O)COc1cccc(Cl)c1)c1cccc(C)c1
InChIInChI=1S/C17H18ClNO2/c1-3-19(15-8-4-6-13(2)10-15)17(20)12-21-16-9-5-7-14(18)11-16/h4-11H,3,12H2,1-2H3
InChIKeyNRGIEWHGZDHDNW-UHFFFAOYSA-N
XLogP4.08
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.79
LogP ≤ 54.08
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2-(4-chloro-2-methylphenoxy)-N-ethyl-N-(3-methylphenyl)acetamide
CID 112978898
N-(2-aminophenyl)-2-(3-chlorophenoxy)-N-ethylacetamide
CID 62229641
N-ethyl-N-(3-methylphenyl)-2-(2,3,6-trimethylphenoxy)acetamide
CID 112977990
N-ethyl-N-(3-methylphenyl)-3-phenoxypropanamide
CID 113099032
2-(2,4-dichlorophenoxy)-N-(3-methylphenyl)-N-propylacetamide
CID 17321195
N-benzyl-2-(3-methylphenoxy)-N-phenylacetamide
CID 112977258
N-ethyl-N-(3-methylphenyl)carbamoyl chloride
CID 79001605
2-(4-bromo-2-fluorophenoxy)-N-ethyl-N-(3-methylphenyl)acetamide
CID 47024393
3-amino-N-ethyl-N-(3-methylphenyl)propanamide
CID 22692119
2-(N-acetyl-5-chloro-2-methylanilino)-N-ethyl-N-(3-methylphenyl)acetamide
CID 113171988
ethyl 4-(N-ethyl-3-methylanilino)-4-oxobutanoate
CID 60737731
2-(4-chlorophenoxy)-N-(3,4-difluorophenyl)-N-ethylacetamide
CID 55593364

Frequently Asked Questions

What is the IUPAC name of 2-(3-chlorophenoxy)-N-ethyl-N-(3-methylphenyl)acetamide?
The IUPAC name of 2-(3-chlorophenoxy)-N-ethyl-N-(3-methylphenyl)acetamide (CID 112977302) is 2-(3-chlorophenoxy)-N-ethyl-N-(3-methylphenyl)acetamide.
What is the SMILES notation for 2-(3-chlorophenoxy)-N-ethyl-N-(3-methylphenyl)acetamide?
The canonical SMILES for 2-(3-chlorophenoxy)-N-ethyl-N-(3-methylphenyl)acetamide is CCN(C(=O)COc1cccc(Cl)c1)c1cccc(C)c1.
What is the InChIKey of 2-(3-chlorophenoxy)-N-ethyl-N-(3-methylphenyl)acetamide?
The InChIKey is NRGIEWHGZDHDNW-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18ClNO2/c1-3-19(15-8-4-6-13(2)10-15)17(20)12-21-16-9-5-7-14(18)11-16/h4-11H,3,12H2,1-2H3.
What are the key properties of 2-(3-chlorophenoxy)-N-ethyl-N-(3-methylphenyl)acetamide?
2-(3-chlorophenoxy)-N-ethyl-N-(3-methylphenyl)acetamide has a molecular weight of 303.79 g/mol, XLogP of 4.08, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-chlorophenoxy)-N-ethyl-N-(3-methylphenyl)acetamide is sourced from PubChem (CID 112977302), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).