2-[3-chloro-2-(hydroxymethyl)phenoxy]-N-(3-chlorophenyl)acetamide

C15H13Cl2NO3 — CID 114320702

IUPAC2-[3-chloro-2-(hydroxymethyl)phenoxy]-N-(3-chlorophenyl)acetamide
SMILESO=C(COc1cccc(Cl)c1CO)Nc1cccc(Cl)c1
InChIInChI=1S/C15H13Cl2NO3/c16-10-3-1-4-11(7-10)18-15(20)9-21-14-6-2-5-13(17)12(14)8-19/h1-7,19H,8-9H2,(H,18,20)
InChIKeyFYOMUDZEFFNGPA-UHFFFAOYSA-N
MW326.18 g/mol
LogP3.50
Rot. Bonds5

About 2-[3-chloro-2-(hydroxymethyl)phenoxy]-N-(3-chlorophenyl)acetamide

2-[3-chloro-2-(hydroxymethyl)phenoxy]-N-(3-chlorophenyl)acetamide (PubChem CID 114320702) has the molecular formula C15H13Cl2NO3 and a molecular weight of 326.18 g/mol. Its IUPAC name is 2-[3-chloro-2-(hydroxymethyl)phenoxy]-N-(3-chlorophenyl)acetamide.

Molecular Properties

Compound Name2-[3-chloro-2-(hydroxymethyl)phenoxy]-N-(3-chlorophenyl)acetamide
PubChem CID114320702
Molecular FormulaC15H13Cl2NO3
Molecular Weight326.18 g/mol
Exact Mass325.03
IUPAC Name2-[3-chloro-2-(hydroxymethyl)phenoxy]-N-(3-chlorophenyl)acetamide
SMILESO=C(COc1cccc(Cl)c1CO)Nc1cccc(Cl)c1
InChIInChI=1S/C15H13Cl2NO3/c16-10-3-1-4-11(7-10)18-15(20)9-21-14-6-2-5-13(17)12(14)8-19/h1-7,19H,8-9H2,(H,18,20)
InChIKeyFYOMUDZEFFNGPA-UHFFFAOYSA-N
XLogP3.50
TPSA58.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.18
LogP ≤ 53.50
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(2-chlorophenoxy)-N-(3-chlorophenyl)acetamide
CID 707250
N-(3-chlorophenyl)-2-naphthalen-1-yloxyacetamide
CID 954547
N-(3-chlorophenyl)-2-(2,4-difluorophenoxy)acetamide
CID 17173171
2-(2-chloro-4-methylphenoxy)-N-(3-chlorophenyl)acetamide
CID 161150821
N-(3-chlorophenyl)-2-[2-fluoro-4-(hydroxymethyl)phenoxy]acetamide
CID 107690723
2-[2-(aminomethyl)-3-chlorophenoxy]-N-(3-bromophenyl)acetamide
CID 114318480
2-(2,5-dichlorophenoxy)-N-[3-(hydroxymethyl)phenyl]acetamide
CID 60703773
N-[3-[[2-(2-chlorophenoxy)acetyl]amino]phenyl]propanamide
CID 17027266
2-[3-chloro-2-(hydroxymethyl)phenoxy]-N-propylacetamide
CID 114320622
N-(3-chlorophenyl)-2-(2,3,5-trimethylphenoxy)acetamide
CID 19177306
2-(2-chlorophenoxy)-N-phenylacetamide
CID 853450
2-(4-bromo-2-methylphenoxy)-N-(3-chlorophenyl)acetamide
CID 3483118

Frequently Asked Questions

What is the IUPAC name of 2-[3-chloro-2-(hydroxymethyl)phenoxy]-N-(3-chlorophenyl)acetamide?
The IUPAC name of 2-[3-chloro-2-(hydroxymethyl)phenoxy]-N-(3-chlorophenyl)acetamide (CID 114320702) is 2-[3-chloro-2-(hydroxymethyl)phenoxy]-N-(3-chlorophenyl)acetamide.
What is the SMILES notation for 2-[3-chloro-2-(hydroxymethyl)phenoxy]-N-(3-chlorophenyl)acetamide?
The canonical SMILES for 2-[3-chloro-2-(hydroxymethyl)phenoxy]-N-(3-chlorophenyl)acetamide is O=C(COc1cccc(Cl)c1CO)Nc1cccc(Cl)c1.
What is the InChIKey of 2-[3-chloro-2-(hydroxymethyl)phenoxy]-N-(3-chlorophenyl)acetamide?
The InChIKey is FYOMUDZEFFNGPA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13Cl2NO3/c16-10-3-1-4-11(7-10)18-15(20)9-21-14-6-2-5-13(17)12(14)8-19/h1-7,19H,8-9H2,(H,18,20).
What are the key properties of 2-[3-chloro-2-(hydroxymethyl)phenoxy]-N-(3-chlorophenyl)acetamide?
2-[3-chloro-2-(hydroxymethyl)phenoxy]-N-(3-chlorophenyl)acetamide has a molecular weight of 326.18 g/mol, XLogP of 3.50, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-chloro-2-(hydroxymethyl)phenoxy]-N-(3-chlorophenyl)acetamide is sourced from PubChem (CID 114320702), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).