N-(2,6-dichlorophenyl)-2-(2-phenylethoxy)benzamide

C21H17Cl2NO2 — CID 54785858

IUPACN-(2,6-dichlorophenyl)-2-(2-phenylethoxy)benzamide
SMILESO=C(Nc1c(Cl)cccc1Cl)c1ccccc1OCCc1ccccc1
InChIInChI=1S/C21H17Cl2NO2/c22-17-10-6-11-18(23)20(17)24-21(25)16-9-4-5-12-19(16)26-14-13-15-7-2-1-3-8-15/h1-12H,13-14H2,(H,24,25)
InChIKeyKXCYJFOXLDNSDB-UHFFFAOYSA-N
MW386.28 g/mol
LogP5.87
Rot. Bonds6

About N-(2,6-dichlorophenyl)-2-(2-phenylethoxy)benzamide

N-(2,6-dichlorophenyl)-2-(2-phenylethoxy)benzamide (PubChem CID 54785858) has the molecular formula C21H17Cl2NO2 and a molecular weight of 386.28 g/mol. Its IUPAC name is N-(2,6-dichlorophenyl)-2-(2-phenylethoxy)benzamide.

Molecular Properties

Compound NameN-(2,6-dichlorophenyl)-2-(2-phenylethoxy)benzamide
PubChem CID54785858
Molecular FormulaC21H17Cl2NO2
Molecular Weight386.28 g/mol
Exact Mass385.06
IUPAC NameN-(2,6-dichlorophenyl)-2-(2-phenylethoxy)benzamide
SMILESO=C(Nc1c(Cl)cccc1Cl)c1ccccc1OCCc1ccccc1
InChIInChI=1S/C21H17Cl2NO2/c22-17-10-6-11-18(23)20(17)24-21(25)16-9-4-5-12-19(16)26-14-13-15-7-2-1-3-8-15/h1-12H,13-14H2,(H,24,25)
InChIKeyKXCYJFOXLDNSDB-UHFFFAOYSA-N
XLogP5.87
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500386.28
LogP ≤ 55.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N'-(2-chlorobenzoyl)-2-(2-phenylethoxy)benzohydrazide
CID 19628253
2-(2-phenylethoxy)-N-[3-(2-phenylethoxy)phenyl]benzamide
CID 17142269
N-(3-chloro-4-methoxyphenyl)-2-(2-phenylethoxy)benzamide
CID 19628178
N-(2-bromophenyl)-2-(2-phenylethoxy)benzamide
CID 19628130
N-[3-[(3-chloro-4-fluorophenyl)carbamoyl]phenyl]-2-(2-phenylethoxy)benzamide
CID 26166889
2-(2-phenylethoxy)-N-(3-propan-2-yloxyphenyl)benzamide
CID 17154818
N-(4-butoxyphenyl)-2-(2-phenylethoxy)benzamide
CID 19628186
N-(2,5-dimethylphenyl)-2-(2-phenylethoxy)benzamide
CID 19628089
N-[3-(benzylcarbamoyl)phenyl]-2-(2-phenylethoxy)benzamide
CID 28638963
2-chloro-N-[3-(3-phenylpropoxy)phenyl]benzamide
CID 17133169
2-(3-methylbutoxy)-N-[3-(2-phenylethoxy)phenyl]benzamide
CID 17142197
5-bromo-2-(2-phenylethoxy)-N-(2,4,5-trichlorophenyl)benzamide
CID 17046139

Frequently Asked Questions

What is the IUPAC name of N-(2,6-dichlorophenyl)-2-(2-phenylethoxy)benzamide?
The IUPAC name of N-(2,6-dichlorophenyl)-2-(2-phenylethoxy)benzamide (CID 54785858) is N-(2,6-dichlorophenyl)-2-(2-phenylethoxy)benzamide.
What is the SMILES notation for N-(2,6-dichlorophenyl)-2-(2-phenylethoxy)benzamide?
The canonical SMILES for N-(2,6-dichlorophenyl)-2-(2-phenylethoxy)benzamide is O=C(Nc1c(Cl)cccc1Cl)c1ccccc1OCCc1ccccc1.
What is the InChIKey of N-(2,6-dichlorophenyl)-2-(2-phenylethoxy)benzamide?
The InChIKey is KXCYJFOXLDNSDB-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H17Cl2NO2/c22-17-10-6-11-18(23)20(17)24-21(25)16-9-4-5-12-19(16)26-14-13-15-7-2-1-3-8-15/h1-12H,13-14H2,(H,24,25).
What are the key properties of N-(2,6-dichlorophenyl)-2-(2-phenylethoxy)benzamide?
N-(2,6-dichlorophenyl)-2-(2-phenylethoxy)benzamide has a molecular weight of 386.28 g/mol, XLogP of 5.87, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,6-dichlorophenyl)-2-(2-phenylethoxy)benzamide is sourced from PubChem (CID 54785858), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).