2-(2,4-dichlorophenyl)-N-[[3-(hydroxymethyl)phenyl]methyl]acetamide

C16H15Cl2NO2 — CID 63311270

IUPAC2-(2,4-dichlorophenyl)-N-[[3-(hydroxymethyl)phenyl]methyl]acetamide
SMILESO=C(Cc1ccc(Cl)cc1Cl)NCc1cccc(CO)c1
InChIInChI=1S/C16H15Cl2NO2/c17-14-5-4-13(15(18)8-14)7-16(21)19-9-11-2-1-3-12(6-11)10-20/h1-6,8,20H,7,9-10H2,(H,19,21)
InChIKeyZUHJHXUHOFOEST-UHFFFAOYSA-N
MW324.21 g/mol
LogP3.34
Rot. Bonds5

About 2-(2,4-dichlorophenyl)-N-[[3-(hydroxymethyl)phenyl]methyl]acetamide

2-(2,4-dichlorophenyl)-N-[[3-(hydroxymethyl)phenyl]methyl]acetamide (PubChem CID 63311270) has the molecular formula C16H15Cl2NO2 and a molecular weight of 324.21 g/mol. Its IUPAC name is 2-(2,4-dichlorophenyl)-N-[[3-(hydroxymethyl)phenyl]methyl]acetamide.

Molecular Properties

Compound Name2-(2,4-dichlorophenyl)-N-[[3-(hydroxymethyl)phenyl]methyl]acetamide
PubChem CID63311270
Molecular FormulaC16H15Cl2NO2
Molecular Weight324.21 g/mol
Exact Mass323.05
IUPAC Name2-(2,4-dichlorophenyl)-N-[[3-(hydroxymethyl)phenyl]methyl]acetamide
SMILESO=C(Cc1ccc(Cl)cc1Cl)NCc1cccc(CO)c1
InChIInChI=1S/C16H15Cl2NO2/c17-14-5-4-13(15(18)8-14)7-16(21)19-9-11-2-1-3-12(6-11)10-20/h1-6,8,20H,7,9-10H2,(H,19,21)
InChIKeyZUHJHXUHOFOEST-UHFFFAOYSA-N
XLogP3.34
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.21
LogP ≤ 53.34
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2,4-dichloro-N-[[3-(hydroxymethyl)phenyl]methyl]benzamide
CID 63311480
N-[(4-chlorophenyl)methyl]-2-(2,4-dichlorophenyl)acetamide
CID 1226021
2-(2,4-dichlorophenyl)-N-[(3-methoxyphenyl)methyl]acetamide
CID 9495803
2-(2-chloro-6-fluorophenyl)-N-[[3-(hydroxymethyl)phenyl]methyl]acetamide
CID 63310904
[2-[(3-chlorophenyl)methylamino]-2-oxoethyl] 2-(2,4-dichlorophenyl)acetate
CID 7762959
2-(4-chlorophenoxy)-N-[[3-(hydroxymethyl)phenyl]methyl]acetamide
CID 63311483
2-amino-5-chloro-N-[[3-(hydroxymethyl)phenyl]methyl]benzamide
CID 107210212
2-(3-aminophenyl)-N-[[3-(hydroxymethyl)phenyl]methyl]acetamide
CID 107210221
1-(3-chlorophenyl)-3-[[3-(hydroxymethyl)phenyl]methyl]urea
CID 63312020
2-bromo-N-[[3-(hydroxymethyl)phenyl]methyl]acetamide
CID 107216595
N-benzyl-2-[(2,4-dichlorophenyl)methylamino]acetamide
CID 60647537
N-[[3-(hydroxymethyl)phenyl]methyl]-2-thiophen-3-ylacetamide
CID 63311259

Frequently Asked Questions

What is the IUPAC name of 2-(2,4-dichlorophenyl)-N-[[3-(hydroxymethyl)phenyl]methyl]acetamide?
The IUPAC name of 2-(2,4-dichlorophenyl)-N-[[3-(hydroxymethyl)phenyl]methyl]acetamide (CID 63311270) is 2-(2,4-dichlorophenyl)-N-[[3-(hydroxymethyl)phenyl]methyl]acetamide.
What is the SMILES notation for 2-(2,4-dichlorophenyl)-N-[[3-(hydroxymethyl)phenyl]methyl]acetamide?
The canonical SMILES for 2-(2,4-dichlorophenyl)-N-[[3-(hydroxymethyl)phenyl]methyl]acetamide is O=C(Cc1ccc(Cl)cc1Cl)NCc1cccc(CO)c1.
What is the InChIKey of 2-(2,4-dichlorophenyl)-N-[[3-(hydroxymethyl)phenyl]methyl]acetamide?
The InChIKey is ZUHJHXUHOFOEST-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15Cl2NO2/c17-14-5-4-13(15(18)8-14)7-16(21)19-9-11-2-1-3-12(6-11)10-20/h1-6,8,20H,7,9-10H2,(H,19,21).
What are the key properties of 2-(2,4-dichlorophenyl)-N-[[3-(hydroxymethyl)phenyl]methyl]acetamide?
2-(2,4-dichlorophenyl)-N-[[3-(hydroxymethyl)phenyl]methyl]acetamide has a molecular weight of 324.21 g/mol, XLogP of 3.34, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,4-dichlorophenyl)-N-[[3-(hydroxymethyl)phenyl]methyl]acetamide is sourced from PubChem (CID 63311270), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).