3-[(3,4-dichlorophenyl)methoxy]-N-ethylbenzamide

C16H15Cl2NO2 — CID 8814822

IUPAC3-[(3,4-dichlorophenyl)methoxy]-N-ethylbenzamide
SMILESCCNC(=O)c1cccc(OCc2ccc(Cl)c(Cl)c2)c1
InChIInChI=1S/C16H15Cl2NO2/c1-2-19-16(20)12-4-3-5-13(9-12)21-10-11-6-7-14(17)15(18)8-11/h3-9H,2,10H2,1H3,(H,19,20)
InChIKeyRNNPMZMJKSJAAK-UHFFFAOYSA-N
MW324.21 g/mol
LogP4.32
Rot. Bonds5

About 3-[(3,4-dichlorophenyl)methoxy]-N-ethylbenzamide

3-[(3,4-dichlorophenyl)methoxy]-N-ethylbenzamide (PubChem CID 8814822) has the molecular formula C16H15Cl2NO2 and a molecular weight of 324.21 g/mol. Its IUPAC name is 3-[(3,4-dichlorophenyl)methoxy]-N-ethylbenzamide.

Molecular Properties

Compound Name3-[(3,4-dichlorophenyl)methoxy]-N-ethylbenzamide
PubChem CID8814822
Molecular FormulaC16H15Cl2NO2
Molecular Weight324.21 g/mol
Exact Mass323.05
IUPAC Name3-[(3,4-dichlorophenyl)methoxy]-N-ethylbenzamide
SMILESCCNC(=O)c1cccc(OCc2ccc(Cl)c(Cl)c2)c1
InChIInChI=1S/C16H15Cl2NO2/c1-2-19-16(20)12-4-3-5-13(9-12)21-10-11-6-7-14(17)15(18)8-11/h3-9H,2,10H2,1H3,(H,19,20)
InChIKeyRNNPMZMJKSJAAK-UHFFFAOYSA-N
XLogP4.32
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.21
LogP ≤ 54.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-[(3,4-dichlorophenyl)methoxy]benzohydrazide
CID 91682824
3-[(3,4-dichlorophenyl)methoxy]-N-(3-methoxypropyl)benzamide
CID 8815252
3-[(3,4-dichlorophenyl)methoxy]-N-(4-ethylphenyl)benzamide
CID 8814622
3-[[3-[(3,4-dichlorophenyl)methoxy]benzoyl]amino]propyl-dimethylazanium
CID 8815091
3-[(3,4-dichlorophenyl)methoxy]-N-(3-methylphenyl)benzamide
CID 8814570
3-[(3,4-dichlorophenoxy)methyl]benzohydrazide
CID 63575567
3,4-dichloro-N-[2-[[3-(pyridin-3-ylmethoxy)benzoyl]amino]ethyl]benzamide
CID 78889118
3-[(4-chlorophenyl)methoxy]-N-(2-methylpropyl)benzamide
CID 13176390
N-(3,4-dichlorophenyl)-3-phenylmethoxybenzamide
CID 17148514
3-(2,5-dichlorophenoxy)-N-ethylbenzamide
CID 12941782
3-[(4-propan-2-ylphenyl)methoxy]-N-propylbenzamide
CID 86031288
[3-[(3,4-dichlorophenyl)methoxy]phenyl]-(4-methylpiperidin-1-yl)methanone
CID 8815161

Frequently Asked Questions

What is the IUPAC name of 3-[(3,4-dichlorophenyl)methoxy]-N-ethylbenzamide?
The IUPAC name of 3-[(3,4-dichlorophenyl)methoxy]-N-ethylbenzamide (CID 8814822) is 3-[(3,4-dichlorophenyl)methoxy]-N-ethylbenzamide.
What is the SMILES notation for 3-[(3,4-dichlorophenyl)methoxy]-N-ethylbenzamide?
The canonical SMILES for 3-[(3,4-dichlorophenyl)methoxy]-N-ethylbenzamide is CCNC(=O)c1cccc(OCc2ccc(Cl)c(Cl)c2)c1.
What is the InChIKey of 3-[(3,4-dichlorophenyl)methoxy]-N-ethylbenzamide?
The InChIKey is RNNPMZMJKSJAAK-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15Cl2NO2/c1-2-19-16(20)12-4-3-5-13(9-12)21-10-11-6-7-14(17)15(18)8-11/h3-9H,2,10H2,1H3,(H,19,20).
What are the key properties of 3-[(3,4-dichlorophenyl)methoxy]-N-ethylbenzamide?
3-[(3,4-dichlorophenyl)methoxy]-N-ethylbenzamide has a molecular weight of 324.21 g/mol, XLogP of 4.32, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(3,4-dichlorophenyl)methoxy]-N-ethylbenzamide is sourced from PubChem (CID 8814822), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).