2-(2,5-dichlorophenoxy)-N-[2-(dimethylamino)ethyl]acetamide

C12H16Cl2N2O2 — CID 19165328

IUPAC2-(2,5-dichlorophenoxy)-N-[2-(dimethylamino)ethyl]acetamide
SMILESCN(C)CCNC(=O)COc1cc(Cl)ccc1Cl
InChIInChI=1S/C12H16Cl2N2O2/c1-16(2)6-5-15-12(17)8-18-11-7-9(13)3-4-10(11)14/h3-4,7H,5-6,8H2,1-2H3,(H,15,17)
InChIKeyUKBUWLJPJOKLTQ-UHFFFAOYSA-N
MW291.18 g/mol
LogP2.05
Rot. Bonds6

About 2-(2,5-dichlorophenoxy)-N-[2-(dimethylamino)ethyl]acetamide

2-(2,5-dichlorophenoxy)-N-[2-(dimethylamino)ethyl]acetamide (PubChem CID 19165328) has the molecular formula C12H16Cl2N2O2 and a molecular weight of 291.18 g/mol. Its IUPAC name is 2-(2,5-dichlorophenoxy)-N-[2-(dimethylamino)ethyl]acetamide.

Molecular Properties

Compound Name2-(2,5-dichlorophenoxy)-N-[2-(dimethylamino)ethyl]acetamide
PubChem CID19165328
Molecular FormulaC12H16Cl2N2O2
Molecular Weight291.18 g/mol
Exact Mass290.06
IUPAC Name2-(2,5-dichlorophenoxy)-N-[2-(dimethylamino)ethyl]acetamide
SMILESCN(C)CCNC(=O)COc1cc(Cl)ccc1Cl
InChIInChI=1S/C12H16Cl2N2O2/c1-16(2)6-5-15-12(17)8-18-11-7-9(13)3-4-10(11)14/h3-4,7H,5-6,8H2,1-2H3,(H,15,17)
InChIKeyUKBUWLJPJOKLTQ-UHFFFAOYSA-N
XLogP2.05
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.18
LogP ≤ 52.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(2,5-dichlorophenoxy)-N-[2-(ethylamino)ethyl]acetamide;hydrochloride
CID 119504659
2-(2,5-dichlorophenoxy)-N-(2-hydroxypropyl)acetamide
CID 43394146
2-(2,5-dichlorophenoxy)-N-(3-ethoxypropyl)acetamide
CID 84601595
4-[[2-(2,5-dichlorophenoxy)acetyl]amino]butanoic acid
CID 43241696
N-[2-(4-chlorophenyl)sulfanylethyl]-2-(2,5-dichlorophenoxy)acetamide
CID 18266874
2-[[2-(2,5-dichlorophenoxy)acetyl]amino]-N-propan-2-ylacetamide
CID 47115759
2-(2-chloro-5-methylphenoxy)-N-[2-[di(propan-2-yl)amino]ethyl]acetamide
CID 18160697
2-[[2-(2,5-dichlorophenoxy)acetyl]amino]-N-[4-(dimethylamino)phenyl]acetamide
CID 110615374
2-(2-chloro-5-methylphenoxy)-N-[2-(4-chlorophenyl)ethyl]acetamide
CID 2677051
2-(2,5-dichlorophenoxy)-N-[2-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]acetamide
CID 24681127
2-(2,5-dichlorophenoxy)-N-[3-(4-ethylpiperazin-1-yl)propyl]acetamide
CID 55660167
2-(2,5-dichlorophenoxy)-N-(2-hydroxy-4-methylpentyl)acetamide
CID 103771579

Frequently Asked Questions

What is the IUPAC name of 2-(2,5-dichlorophenoxy)-N-[2-(dimethylamino)ethyl]acetamide?
The IUPAC name of 2-(2,5-dichlorophenoxy)-N-[2-(dimethylamino)ethyl]acetamide (CID 19165328) is 2-(2,5-dichlorophenoxy)-N-[2-(dimethylamino)ethyl]acetamide.
What is the SMILES notation for 2-(2,5-dichlorophenoxy)-N-[2-(dimethylamino)ethyl]acetamide?
The canonical SMILES for 2-(2,5-dichlorophenoxy)-N-[2-(dimethylamino)ethyl]acetamide is CN(C)CCNC(=O)COc1cc(Cl)ccc1Cl.
What is the InChIKey of 2-(2,5-dichlorophenoxy)-N-[2-(dimethylamino)ethyl]acetamide?
The InChIKey is UKBUWLJPJOKLTQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16Cl2N2O2/c1-16(2)6-5-15-12(17)8-18-11-7-9(13)3-4-10(11)14/h3-4,7H,5-6,8H2,1-2H3,(H,15,17).
What are the key properties of 2-(2,5-dichlorophenoxy)-N-[2-(dimethylamino)ethyl]acetamide?
2-(2,5-dichlorophenoxy)-N-[2-(dimethylamino)ethyl]acetamide has a molecular weight of 291.18 g/mol, XLogP of 2.05, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,5-dichlorophenoxy)-N-[2-(dimethylamino)ethyl]acetamide is sourced from PubChem (CID 19165328), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).