4-ethoxy-N-(3-fluoro-4-methylphenyl)benzamide

C16H16FNO2 — CID 2969739

IUPAC4-ethoxy-N-(3-fluoro-4-methylphenyl)benzamide
SMILESCCOc1ccc(C(=O)Nc2ccc(C)c(F)c2)cc1
InChIInChI=1S/C16H16FNO2/c1-3-20-14-8-5-12(6-9-14)16(19)18-13-7-4-11(2)15(17)10-13/h4-10H,3H2,1-2H3,(H,18,19)
InChIKeyPSEQRPKVKQWMGB-UHFFFAOYSA-N
MW273.31 g/mol
LogP3.79
Rot. Bonds4

About 4-ethoxy-N-(3-fluoro-4-methylphenyl)benzamide

4-ethoxy-N-(3-fluoro-4-methylphenyl)benzamide (PubChem CID 2969739) has the molecular formula C16H16FNO2 and a molecular weight of 273.31 g/mol. Its IUPAC name is 4-ethoxy-N-(3-fluoro-4-methylphenyl)benzamide.

Molecular Properties

Compound Name4-ethoxy-N-(3-fluoro-4-methylphenyl)benzamide
PubChem CID2969739
Molecular FormulaC16H16FNO2
Molecular Weight273.31 g/mol
Exact Mass273.12
IUPAC Name4-ethoxy-N-(3-fluoro-4-methylphenyl)benzamide
SMILESCCOc1ccc(C(=O)Nc2ccc(C)c(F)c2)cc1
InChIInChI=1S/C16H16FNO2/c1-3-20-14-8-5-12(6-9-14)16(19)18-13-7-4-11(2)15(17)10-13/h4-10H,3H2,1-2H3,(H,18,19)
InChIKeyPSEQRPKVKQWMGB-UHFFFAOYSA-N
XLogP3.79
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 ≤ 53.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(3-fluoro-4-methylphenyl)-4-propan-2-yloxybenzamide
CID 7778576
N-(3-acetamido-4-fluorophenyl)-4-ethoxybenzamide
CID 46632768
2-(4-ethoxyphenoxy)-N-(3-fluoro-4-methylphenyl)propanamide
CID 24511595
N-[4-[(4-ethoxyphenyl)carbamoyl]phenyl]-3,5-dimethylbenzamide
CID 7929215
4-N-(2,5-dimethylphenyl)-1-N-(4-ethoxyphenyl)benzene-1,4-dicarboxamide
CID 109049620
4-[[2-(3,4-dimethylanilino)-2-oxoethyl]amino]-N-(4-ethoxyphenyl)benzamide
CID 9100799
[2-(3-fluoro-4-methylanilino)-2-oxoethyl] 4-(4-ethoxyphenyl)-4-oxobutanoate
CID 7133058
N-(4-bromo-3,5-dimethylphenyl)-4-ethoxybenzamide
CID 107574997
N-[3-(dimethylsulfamoyl)-4-methylphenyl]-4-ethoxybenzamide
CID 3635933
4-amino-N-(4-ethoxyphenyl)-3-fluorobenzamide
CID 62679243
1-N-(4-ethoxyphenyl)-4-N-(2-fluorophenyl)benzene-1,4-dicarboxamide
CID 109049866
N-(4-ethoxyphenyl)-3,5-difluorobenzamide
CID 8745463

Frequently Asked Questions

What is the IUPAC name of 4-ethoxy-N-(3-fluoro-4-methylphenyl)benzamide?
The IUPAC name of 4-ethoxy-N-(3-fluoro-4-methylphenyl)benzamide (CID 2969739) is 4-ethoxy-N-(3-fluoro-4-methylphenyl)benzamide.
What is the SMILES notation for 4-ethoxy-N-(3-fluoro-4-methylphenyl)benzamide?
The canonical SMILES for 4-ethoxy-N-(3-fluoro-4-methylphenyl)benzamide is CCOc1ccc(C(=O)Nc2ccc(C)c(F)c2)cc1.
What is the InChIKey of 4-ethoxy-N-(3-fluoro-4-methylphenyl)benzamide?
The InChIKey is PSEQRPKVKQWMGB-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16FNO2/c1-3-20-14-8-5-12(6-9-14)16(19)18-13-7-4-11(2)15(17)10-13/h4-10H,3H2,1-2H3,(H,18,19).
What are the key properties of 4-ethoxy-N-(3-fluoro-4-methylphenyl)benzamide?
4-ethoxy-N-(3-fluoro-4-methylphenyl)benzamide has a molecular weight of 273.31 g/mol, XLogP of 3.79, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethoxy-N-(3-fluoro-4-methylphenyl)benzamide is sourced from PubChem (CID 2969739), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).