3-(2,5-dichlorophenoxy)-N-ethylbenzamide

C15H13Cl2NO2 — CID 12941782

IUPAC3-(2,5-dichlorophenoxy)-N-ethylbenzamide
SMILESCCNC(=O)c1cccc(Oc2cc(Cl)ccc2Cl)c1
InChIInChI=1S/C15H13Cl2NO2/c1-2-18-15(19)10-4-3-5-12(8-10)20-14-9-11(16)6-7-13(14)17/h3-9H,2H2,1H3,(H,18,19)
InChIKeyXOBNHVLDKBJXLK-UHFFFAOYSA-N
MW310.18 g/mol
LogP4.54
Rot. Bonds4

About 3-(2,5-dichlorophenoxy)-N-ethylbenzamide

3-(2,5-dichlorophenoxy)-N-ethylbenzamide (PubChem CID 12941782) has the molecular formula C15H13Cl2NO2 and a molecular weight of 310.18 g/mol. Its IUPAC name is 3-(2,5-dichlorophenoxy)-N-ethylbenzamide.

Molecular Properties

Compound Name3-(2,5-dichlorophenoxy)-N-ethylbenzamide
PubChem CID12941782
Molecular FormulaC15H13Cl2NO2
Molecular Weight310.18 g/mol
Exact Mass309.03
IUPAC Name3-(2,5-dichlorophenoxy)-N-ethylbenzamide
SMILESCCNC(=O)c1cccc(Oc2cc(Cl)ccc2Cl)c1
InChIInChI=1S/C15H13Cl2NO2/c1-2-18-15(19)10-4-3-5-12(8-10)20-14-9-11(16)6-7-13(14)17/h3-9H,2H2,1H3,(H,18,19)
InChIKeyXOBNHVLDKBJXLK-UHFFFAOYSA-N
XLogP4.54
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.18
LogP ≤ 54.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-(2-chloro-4-methylphenoxy)-N-ethylbenzamide
CID 12941937
3-(2,4-dimethylphenoxy)-N-ethylbenzamide
CID 12941864
3-[2-(2,5-dichlorophenoxy)ethoxy]-N-(2-methoxyethyl)benzamide
CID 13387095
3-[(3,4-dichlorophenyl)methoxy]-N-ethylbenzamide
CID 8814822
3-(4-bromophenoxy)-N-ethylbenzamide
CID 12941905
1-[3-(2,5-dichlorophenoxy)phenyl]-N-ethylethanamine
CID 79170877
3-(3-chlorophenoxy)-N-(2-hydroxy-2-methylpropyl)benzamide
CID 173147350
3-(2-aminoquinolin-4-yl)oxy-N-ethylbenzamide
CID 166050629
4-amino-3-(3-chlorophenoxy)-N-propylbenzamide;ethane
CID 143138979
3-(4-chloro-3-methylphenoxy)-N-(2-methylpropyl)benzamide
CID 12941943
3-amino-4-(5-chloro-2-methylphenoxy)-N-ethylbenzamide
CID 82990978
N-[(2,5-dichlorophenyl)methyl]-3-(4-nitrophenoxy)benzamide
CID 171677644

Frequently Asked Questions

What is the IUPAC name of 3-(2,5-dichlorophenoxy)-N-ethylbenzamide?
The IUPAC name of 3-(2,5-dichlorophenoxy)-N-ethylbenzamide (CID 12941782) is 3-(2,5-dichlorophenoxy)-N-ethylbenzamide.
What is the SMILES notation for 3-(2,5-dichlorophenoxy)-N-ethylbenzamide?
The canonical SMILES for 3-(2,5-dichlorophenoxy)-N-ethylbenzamide is CCNC(=O)c1cccc(Oc2cc(Cl)ccc2Cl)c1.
What is the InChIKey of 3-(2,5-dichlorophenoxy)-N-ethylbenzamide?
The InChIKey is XOBNHVLDKBJXLK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13Cl2NO2/c1-2-18-15(19)10-4-3-5-12(8-10)20-14-9-11(16)6-7-13(14)17/h3-9H,2H2,1H3,(H,18,19).
What are the key properties of 3-(2,5-dichlorophenoxy)-N-ethylbenzamide?
3-(2,5-dichlorophenoxy)-N-ethylbenzamide has a molecular weight of 310.18 g/mol, XLogP of 4.54, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2,5-dichlorophenoxy)-N-ethylbenzamide is sourced from PubChem (CID 12941782), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).