2-(2,5-dichlorophenoxy)-N-[3-(hydroxymethyl)phenyl]acetamide

C15H13Cl2NO3 — CID 60703773

IUPAC2-(2,5-dichlorophenoxy)-N-[3-(hydroxymethyl)phenyl]acetamide
SMILESO=C(COc1cc(Cl)ccc1Cl)Nc1cccc(CO)c1
InChIInChI=1S/C15H13Cl2NO3/c16-11-4-5-13(17)14(7-11)21-9-15(20)18-12-3-1-2-10(6-12)8-19/h1-7,19H,8-9H2,(H,18,20)
InChIKeyCZKPWQHLVLCDAT-UHFFFAOYSA-N
MW326.18 g/mol
LogP3.50
Rot. Bonds5

About 2-(2,5-dichlorophenoxy)-N-[3-(hydroxymethyl)phenyl]acetamide

2-(2,5-dichlorophenoxy)-N-[3-(hydroxymethyl)phenyl]acetamide (PubChem CID 60703773) has the molecular formula C15H13Cl2NO3 and a molecular weight of 326.18 g/mol. Its IUPAC name is 2-(2,5-dichlorophenoxy)-N-[3-(hydroxymethyl)phenyl]acetamide.

Molecular Properties

Compound Name2-(2,5-dichlorophenoxy)-N-[3-(hydroxymethyl)phenyl]acetamide
PubChem CID60703773
Molecular FormulaC15H13Cl2NO3
Molecular Weight326.18 g/mol
Exact Mass325.03
IUPAC Name2-(2,5-dichlorophenoxy)-N-[3-(hydroxymethyl)phenyl]acetamide
SMILESO=C(COc1cc(Cl)ccc1Cl)Nc1cccc(CO)c1
InChIInChI=1S/C15H13Cl2NO3/c16-11-4-5-13(17)14(7-11)21-9-15(20)18-12-3-1-2-10(6-12)8-19/h1-7,19H,8-9H2,(H,18,20)
InChIKeyCZKPWQHLVLCDAT-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

N-[3-[[2-(2,5-dichlorophenoxy)acetyl]amino]phenyl]furan-2-carboxamide
CID 24647647
N-(3-chlorophenyl)-2-[2-fluoro-4-(hydroxymethyl)phenoxy]acetamide
CID 107690723
2-(2,5-dichlorophenoxy)-N-(3-sulfamoylphenyl)acetamide
CID 7185045
3-[[2-(2,5-dichlorophenoxy)acetyl]amino]-N-methylbenzamide
CID 8578482
2-(2,5-dichlorophenoxy)-N-(3,4-difluorophenyl)acetamide
CID 7185406
2-(2-chlorophenoxy)-N-(3-chlorophenyl)acetamide
CID 707250
2-(2-bromo-4-chlorophenoxy)-N-(3-bromophenyl)acetamide
CID 19202088
2-[3-chloro-2-(hydroxymethyl)phenoxy]-N-(3-chlorophenyl)acetamide
CID 114320702
methyl 5,7-dichloro-4-[2-[3-(hydroxymethyl)anilino]-2-oxoethoxy]naphthalene-2-carboxylate
CID 67479446
N-(4-acetylphenyl)-2-(2,5-dichlorophenoxy)acetamide
CID 724281
2-(2,5-dichlorophenoxy)-N-[4-(methylcarbamoylamino)phenyl]acetamide
CID 46518487
2-(2,5-dichlorophenoxy)-N-naphthalen-1-ylacetamide
CID 19167989

Frequently Asked Questions

What is the IUPAC name of 2-(2,5-dichlorophenoxy)-N-[3-(hydroxymethyl)phenyl]acetamide?
The IUPAC name of 2-(2,5-dichlorophenoxy)-N-[3-(hydroxymethyl)phenyl]acetamide (CID 60703773) is 2-(2,5-dichlorophenoxy)-N-[3-(hydroxymethyl)phenyl]acetamide.
What is the SMILES notation for 2-(2,5-dichlorophenoxy)-N-[3-(hydroxymethyl)phenyl]acetamide?
The canonical SMILES for 2-(2,5-dichlorophenoxy)-N-[3-(hydroxymethyl)phenyl]acetamide is O=C(COc1cc(Cl)ccc1Cl)Nc1cccc(CO)c1.
What is the InChIKey of 2-(2,5-dichlorophenoxy)-N-[3-(hydroxymethyl)phenyl]acetamide?
The InChIKey is CZKPWQHLVLCDAT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13Cl2NO3/c16-11-4-5-13(17)14(7-11)21-9-15(20)18-12-3-1-2-10(6-12)8-19/h1-7,19H,8-9H2,(H,18,20).
What are the key properties of 2-(2,5-dichlorophenoxy)-N-[3-(hydroxymethyl)phenyl]acetamide?
2-(2,5-dichlorophenoxy)-N-[3-(hydroxymethyl)phenyl]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-(2,5-dichlorophenoxy)-N-[3-(hydroxymethyl)phenyl]acetamide is sourced from PubChem (CID 60703773), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).