3-chloro-N-(4-chlorophenyl)-4-ethoxybenzamide

C15H13Cl2NO2 — CID 876518

IUPAC3-chloro-N-(4-chlorophenyl)-4-ethoxybenzamide
SMILESCCOc1ccc(C(=O)Nc2ccc(Cl)cc2)cc1Cl
InChIInChI=1S/C15H13Cl2NO2/c1-2-20-14-8-3-10(9-13(14)17)15(19)18-12-6-4-11(16)5-7-12/h3-9H,2H2,1H3,(H,18,19)
InChIKeyMYVVCYVTEYXQRH-UHFFFAOYSA-N
MW310.18 g/mol
LogP4.64
Rot. Bonds4

About 3-chloro-N-(4-chlorophenyl)-4-ethoxybenzamide

3-chloro-N-(4-chlorophenyl)-4-ethoxybenzamide (PubChem CID 876518) has the molecular formula C15H13Cl2NO2 and a molecular weight of 310.18 g/mol. Its IUPAC name is 3-chloro-N-(4-chlorophenyl)-4-ethoxybenzamide.

Molecular Properties

Compound Name3-chloro-N-(4-chlorophenyl)-4-ethoxybenzamide
PubChem CID876518
Molecular FormulaC15H13Cl2NO2
Molecular Weight310.18 g/mol
Exact Mass309.03
IUPAC Name3-chloro-N-(4-chlorophenyl)-4-ethoxybenzamide
SMILESCCOc1ccc(C(=O)Nc2ccc(Cl)cc2)cc1Cl
InChIInChI=1S/C15H13Cl2NO2/c1-2-20-14-8-3-10(9-13(14)17)15(19)18-12-6-4-11(16)5-7-12/h3-9H,2H2,1H3,(H,18,19)
InChIKeyMYVVCYVTEYXQRH-UHFFFAOYSA-N
XLogP4.64
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 ≤ 54.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[4-[(4-tert-butylbenzoyl)amino]phenyl]-3-chloro-4-ethoxybenzamide
CID 15991907
3-chloro-N-(3,5-dimethylphenyl)-4-ethoxybenzamide
CID 806791
3-chloro-N-(3-chloro-4-ethoxyphenyl)-4-iodobenzamide
CID 103221287
N-(3-chloro-4-fluorophenyl)-3,4-diethoxybenzamide
CID 3371739
cyclohexyl 4-[(3-chloro-4-ethoxybenzoyl)amino]benzoate
CID 17128645
4-butoxy-3-chloro-N-(4-chlorophenyl)-5-ethoxybenzamide
CID 7900588
N-[(4-acetamidophenyl)carbamothioyl]-3-chloro-4-ethoxybenzamide
CID 1338767
4-amino-N-(3-chloro-4-ethoxyphenyl)-3-hydroxybenzamide
CID 107074269
N-(3-chloro-4-ethoxyphenyl)pyridine-4-carboxamide
CID 110777433
N-[3-(bromomethyl)-4-ethoxyphenyl]-4-chlorobenzamide
CID 114313641
4-[(3-chloro-4-ethoxybenzoyl)carbamothioylamino]benzoate
CID 6980598
N-(3,4-difluorophenyl)-3,4-diethoxybenzamide
CID 3371741

Frequently Asked Questions

What is the IUPAC name of 3-chloro-N-(4-chlorophenyl)-4-ethoxybenzamide?
The IUPAC name of 3-chloro-N-(4-chlorophenyl)-4-ethoxybenzamide (CID 876518) is 3-chloro-N-(4-chlorophenyl)-4-ethoxybenzamide.
What is the SMILES notation for 3-chloro-N-(4-chlorophenyl)-4-ethoxybenzamide?
The canonical SMILES for 3-chloro-N-(4-chlorophenyl)-4-ethoxybenzamide is CCOc1ccc(C(=O)Nc2ccc(Cl)cc2)cc1Cl.
What is the InChIKey of 3-chloro-N-(4-chlorophenyl)-4-ethoxybenzamide?
The InChIKey is MYVVCYVTEYXQRH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13Cl2NO2/c1-2-20-14-8-3-10(9-13(14)17)15(19)18-12-6-4-11(16)5-7-12/h3-9H,2H2,1H3,(H,18,19).
What are the key properties of 3-chloro-N-(4-chlorophenyl)-4-ethoxybenzamide?
3-chloro-N-(4-chlorophenyl)-4-ethoxybenzamide has a molecular weight of 310.18 g/mol, XLogP of 4.64, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-chloro-N-(4-chlorophenyl)-4-ethoxybenzamide is sourced from PubChem (CID 876518), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).