2-(3,5-dichlorophenoxy)-N-propan-2-ylacetamide

C11H13Cl2NO2 — CID 84603835

IUPAC2-(3,5-dichlorophenoxy)-N-propan-2-ylacetamide
SMILESCC(C)NC(=O)COc1cc(Cl)cc(Cl)c1
InChIInChI=1S/C11H13Cl2NO2/c1-7(2)14-11(15)6-16-10-4-8(12)3-9(13)5-10/h3-5,7H,6H2,1-2H3,(H,14,15)
InChIKeyJTURQEPBRMXUNO-UHFFFAOYSA-N
MW262.14 g/mol
LogP2.90
Rot. Bonds4

About 2-(3,5-dichlorophenoxy)-N-propan-2-ylacetamide

2-(3,5-dichlorophenoxy)-N-propan-2-ylacetamide (PubChem CID 84603835) has the molecular formula C11H13Cl2NO2 and a molecular weight of 262.14 g/mol. Its IUPAC name is 2-(3,5-dichlorophenoxy)-N-propan-2-ylacetamide.

Molecular Properties

Compound Name2-(3,5-dichlorophenoxy)-N-propan-2-ylacetamide
PubChem CID84603835
Molecular FormulaC11H13Cl2NO2
Molecular Weight262.14 g/mol
Exact Mass261.03
IUPAC Name2-(3,5-dichlorophenoxy)-N-propan-2-ylacetamide
SMILESCC(C)NC(=O)COc1cc(Cl)cc(Cl)c1
InChIInChI=1S/C11H13Cl2NO2/c1-7(2)14-11(15)6-16-10-4-8(12)3-9(13)5-10/h3-5,7H,6H2,1-2H3,(H,14,15)
InChIKeyJTURQEPBRMXUNO-UHFFFAOYSA-N
XLogP2.90
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.14
LogP ≤ 52.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[(2S)-1-aminopropan-2-yl]-2-(3,5-dichlorophenoxy)acetamide;hydrochloride
CID 120506340
2-(3,5-dichlorophenoxy)-N-(1-phenylethyl)acetamide
CID 18165800
2-(3,5-dichlorophenoxy)-N-methylacetamide
CID 7848470
N-propan-2-yl-2-(2,4,6-trichlorophenoxy)acetamide;hydrate
CID 131860957
2-(4-chloro-3-ethylphenoxy)-N-propan-2-ylacetamide
CID 84602074
2-(3,5-dichlorophenoxy)-N-[1-(1,3-thiazol-2-yl)ethyl]acetamide
CID 71994849
2-phenoxy-N-propan-2-ylacetamide
CID 3614481
3,5-dichloro-2-[2-oxo-2-(propan-2-ylamino)ethoxy]benzoic acid
CID 43516130
N-(3-aminobutyl)-2-(3,5-dichlorophenoxy)acetamide;hydrochloride
CID 119496606
2-(3,5-dichlorophenoxy)-N-[1-(1,2,4-triazol-1-yl)propan-2-yl]acetamide
CID 71995156
N-(2-amino-1-cyclopropylethyl)-2-(3,5-dichlorophenoxy)acetamide
CID 119614628
2-[3,5-dichloro-4-[(4-hydroxy-3-propan-2-ylphenyl)methyl]phenoxy]-N-propan-2-ylacetamide
CID 166119149

Frequently Asked Questions

What is the IUPAC name of 2-(3,5-dichlorophenoxy)-N-propan-2-ylacetamide?
The IUPAC name of 2-(3,5-dichlorophenoxy)-N-propan-2-ylacetamide (CID 84603835) is 2-(3,5-dichlorophenoxy)-N-propan-2-ylacetamide.
What is the SMILES notation for 2-(3,5-dichlorophenoxy)-N-propan-2-ylacetamide?
The canonical SMILES for 2-(3,5-dichlorophenoxy)-N-propan-2-ylacetamide is CC(C)NC(=O)COc1cc(Cl)cc(Cl)c1.
What is the InChIKey of 2-(3,5-dichlorophenoxy)-N-propan-2-ylacetamide?
The InChIKey is JTURQEPBRMXUNO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13Cl2NO2/c1-7(2)14-11(15)6-16-10-4-8(12)3-9(13)5-10/h3-5,7H,6H2,1-2H3,(H,14,15).
What are the key properties of 2-(3,5-dichlorophenoxy)-N-propan-2-ylacetamide?
2-(3,5-dichlorophenoxy)-N-propan-2-ylacetamide has a molecular weight of 262.14 g/mol, XLogP of 2.90, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3,5-dichlorophenoxy)-N-propan-2-ylacetamide is sourced from PubChem (CID 84603835), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).