2-(5-chloro-2-ethoxyphenyl)-6-fluorobenzamide

C15H13ClFNO2 — CID 72866292

IUPAC2-(5-chloro-2-ethoxyphenyl)-6-fluorobenzamide
SMILESCCOc1ccc(Cl)cc1-c1cccc(F)c1C(N)=O
InChIInChI=1S/C15H13ClFNO2/c1-2-20-13-7-6-9(16)8-11(13)10-4-3-5-12(17)14(10)15(18)19/h3-8H,2H2,1H3,(H2,18,19)
InChIKeyFDSATRJHFZJKJI-UHFFFAOYSA-N
MW293.73 g/mol
LogP3.64
Rot. Bonds4

About 2-(5-chloro-2-ethoxyphenyl)-6-fluorobenzamide

2-(5-chloro-2-ethoxyphenyl)-6-fluorobenzamide (PubChem CID 72866292) has the molecular formula C15H13ClFNO2 and a molecular weight of 293.73 g/mol. Its IUPAC name is 2-(5-chloro-2-ethoxyphenyl)-6-fluorobenzamide.

Molecular Properties

Compound Name2-(5-chloro-2-ethoxyphenyl)-6-fluorobenzamide
PubChem CID72866292
Molecular FormulaC15H13ClFNO2
Molecular Weight293.73 g/mol
Exact Mass293.06
IUPAC Name2-(5-chloro-2-ethoxyphenyl)-6-fluorobenzamide
SMILESCCOc1ccc(Cl)cc1-c1cccc(F)c1C(N)=O
InChIInChI=1S/C15H13ClFNO2/c1-2-20-13-7-6-9(16)8-11(13)10-4-3-5-12(17)14(10)15(18)19/h3-8H,2H2,1H3,(H2,18,19)
InChIKeyFDSATRJHFZJKJI-UHFFFAOYSA-N
XLogP3.64
TPSA52.32 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.73
LogP ≤ 53.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4-chloro-2-ethoxybenzamide
CID 126998915
N-(3,4-diethoxyphenyl)-2,6-difluorobenzamide
CID 26212684
ethyl 2-(3,5-dichlorophenyl)-6-fluorobenzoate
CID 134623708
2-bromo-N-(3-chloro-4-ethoxyphenyl)-6-fluorobenzamide
CID 115678420
ethyl 2-amino-2-(5-chloro-2-ethoxyphenyl)propanoate
CID 4026471
[(Z)-(5-chloro-2-ethoxyphenyl)methylideneamino]urea
CID 5426098
2-(2,2-diethoxyethoxy)-6-fluorobenzamide
CID 63630436
N-[(Z)-(5-chloro-2-ethoxyphenyl)methylideneamino]-3-fluorobenzamide
CID 126110168
ethyl 2-[4-chloro-2-(3-fluorobenzoyl)phenoxy]acetate
CID 58962617
CID 161042703
CID 161042703
2-(2,5-dichloro-4-ethoxyphenyl)-6-fluoroaniline
CID 107602971
5-chloro-2-[2-(2-ethoxyphenoxy)ethoxy]benzenecarbothioamide
CID 20993126

Frequently Asked Questions

What is the IUPAC name of 2-(5-chloro-2-ethoxyphenyl)-6-fluorobenzamide?
The IUPAC name of 2-(5-chloro-2-ethoxyphenyl)-6-fluorobenzamide (CID 72866292) is 2-(5-chloro-2-ethoxyphenyl)-6-fluorobenzamide.
What is the SMILES notation for 2-(5-chloro-2-ethoxyphenyl)-6-fluorobenzamide?
The canonical SMILES for 2-(5-chloro-2-ethoxyphenyl)-6-fluorobenzamide is CCOc1ccc(Cl)cc1-c1cccc(F)c1C(N)=O.
What is the InChIKey of 2-(5-chloro-2-ethoxyphenyl)-6-fluorobenzamide?
The InChIKey is FDSATRJHFZJKJI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13ClFNO2/c1-2-20-13-7-6-9(16)8-11(13)10-4-3-5-12(17)14(10)15(18)19/h3-8H,2H2,1H3,(H2,18,19).
What are the key properties of 2-(5-chloro-2-ethoxyphenyl)-6-fluorobenzamide?
2-(5-chloro-2-ethoxyphenyl)-6-fluorobenzamide has a molecular weight of 293.73 g/mol, XLogP of 3.64, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-chloro-2-ethoxyphenyl)-6-fluorobenzamide is sourced from PubChem (CID 72866292), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).