N-ethyl-3-(4-fluoro-2-methoxyphenyl)benzamide

C16H16FNO2 — CID 56709113

IUPACN-ethyl-3-(4-fluoro-2-methoxyphenyl)benzamide
SMILESCCNC(=O)c1cccc(-c2ccc(F)cc2OC)c1
InChIInChI=1S/C16H16FNO2/c1-3-18-16(19)12-6-4-5-11(9-12)14-8-7-13(17)10-15(14)20-2/h4-10H,3H2,1-2H3,(H,18,19)
InChIKeyMHRCAJMWAFLNCC-UHFFFAOYSA-N
MW273.31 g/mol
LogP3.25
Rot. Bonds4

About N-ethyl-3-(4-fluoro-2-methoxyphenyl)benzamide

N-ethyl-3-(4-fluoro-2-methoxyphenyl)benzamide (PubChem CID 56709113) has the molecular formula C16H16FNO2 and a molecular weight of 273.31 g/mol. Its IUPAC name is N-ethyl-3-(4-fluoro-2-methoxyphenyl)benzamide.

Molecular Properties

Compound NameN-ethyl-3-(4-fluoro-2-methoxyphenyl)benzamide
PubChem CID56709113
Molecular FormulaC16H16FNO2
Molecular Weight273.31 g/mol
Exact Mass273.12
IUPAC NameN-ethyl-3-(4-fluoro-2-methoxyphenyl)benzamide
SMILESCCNC(=O)c1cccc(-c2ccc(F)cc2OC)c1
InChIInChI=1S/C16H16FNO2/c1-3-18-16(19)12-6-4-5-11(9-12)14-8-7-13(17)10-15(14)20-2/h4-10H,3H2,1-2H3,(H,18,19)
InChIKeyMHRCAJMWAFLNCC-UHFFFAOYSA-N
XLogP3.25
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.31
LogP ≤ 53.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[2-[(3-chlorobenzoyl)amino]ethyl]-3-(5-fluoro-2-methoxyphenyl)benzamide
CID 134800977
methyl 3-[3-(ethylcarbamoyl)phenyl]benzoate
CID 70972222
2-[3-(ethylcarbamoyl)phenyl]-6-fluorobenzoic acid
CID 53227842
3-(5-chloro-2-fluoro-4-hydroxyphenyl)-N-ethylbenzamide
CID 137334943
ethane;N-ethyl-3-methylbenzamide;1-fluoro-3-methylbenzene
CID 142892736
3-(2-methoxyphenyl)-N-[(1-methoxypyridin-1-ium-2-yl)methyl]benzamide
CID 170360798
3-(ethylsulfamoyl)-N-(4-fluoro-2-methoxyphenyl)benzamide
CID 33069732
3-[3-(ethylcarbamoyl)phenyl]-5-methoxybenzoic acid
CID 53227846
3-chloro-N-(4-fluoro-2-methoxyphenyl)benzamide
CID 32608919
3-[3-(dimethylcarbamoyl)phenyl]-N-ethylbenzamide
CID 70972215
1-cyclopropyl-N-[[3-(4-fluoro-2-methoxyphenyl)phenyl]methyl]methanamine
CID 72943652
3-fluoro-N-[[1-(2-methoxyphenyl)cyclopropyl]methyl]benzamide
CID 42265812

Frequently Asked Questions

What is the IUPAC name of N-ethyl-3-(4-fluoro-2-methoxyphenyl)benzamide?
The IUPAC name of N-ethyl-3-(4-fluoro-2-methoxyphenyl)benzamide (CID 56709113) is N-ethyl-3-(4-fluoro-2-methoxyphenyl)benzamide.
What is the SMILES notation for N-ethyl-3-(4-fluoro-2-methoxyphenyl)benzamide?
The canonical SMILES for N-ethyl-3-(4-fluoro-2-methoxyphenyl)benzamide is CCNC(=O)c1cccc(-c2ccc(F)cc2OC)c1.
What is the InChIKey of N-ethyl-3-(4-fluoro-2-methoxyphenyl)benzamide?
The InChIKey is MHRCAJMWAFLNCC-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16FNO2/c1-3-18-16(19)12-6-4-5-11(9-12)14-8-7-13(17)10-15(14)20-2/h4-10H,3H2,1-2H3,(H,18,19).
What are the key properties of N-ethyl-3-(4-fluoro-2-methoxyphenyl)benzamide?
N-ethyl-3-(4-fluoro-2-methoxyphenyl)benzamide has a molecular weight of 273.31 g/mol, XLogP of 3.25, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-3-(4-fluoro-2-methoxyphenyl)benzamide is sourced from PubChem (CID 56709113), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).