N-(4-acetylphenyl)-2-fluoro-6-methoxybenzamide

C16H14FNO3 — CID 65434404

IUPACN-(4-acetylphenyl)-2-fluoro-6-methoxybenzamide
SMILESCOc1cccc(F)c1C(=O)Nc1ccc(C(C)=O)cc1
InChIInChI=1S/C16H14FNO3/c1-10(19)11-6-8-12(9-7-11)18-16(20)15-13(17)4-3-5-14(15)21-2/h3-9H,1-2H3,(H,18,20)
InChIKeyPDDPWKWGRPOLAE-UHFFFAOYSA-N
MW287.29 g/mol
LogP3.29
Rot. Bonds4

About N-(4-acetylphenyl)-2-fluoro-6-methoxybenzamide

N-(4-acetylphenyl)-2-fluoro-6-methoxybenzamide (PubChem CID 65434404) has the molecular formula C16H14FNO3 and a molecular weight of 287.29 g/mol. Its IUPAC name is N-(4-acetylphenyl)-2-fluoro-6-methoxybenzamide.

Molecular Properties

Compound NameN-(4-acetylphenyl)-2-fluoro-6-methoxybenzamide
PubChem CID65434404
Molecular FormulaC16H14FNO3
Molecular Weight287.29 g/mol
Exact Mass287.10
IUPAC NameN-(4-acetylphenyl)-2-fluoro-6-methoxybenzamide
SMILESCOc1cccc(F)c1C(=O)Nc1ccc(C(C)=O)cc1
InChIInChI=1S/C16H14FNO3/c1-10(19)11-6-8-12(9-7-11)18-16(20)15-13(17)4-3-5-14(15)21-2/h3-9H,1-2H3,(H,18,20)
InChIKeyPDDPWKWGRPOLAE-UHFFFAOYSA-N
XLogP3.29
TPSA55.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.29
LogP ≤ 53.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-fluoro-N-(4-iodophenyl)-6-methoxybenzamide
CID 65432477
N-[4-(2-aminoethyl)phenyl]-2-fluoro-6-methoxybenzamide
CID 65433013
2-chloro-6-fluoro-N-[4-[(2-methoxyphenyl)carbamoyl]phenyl]benzamide
CID 26522627
N-(4-carbamoylphenyl)-2,6-dimethoxybenzamide
CID 4126051
N-(3-fluoro-4-methoxyphenyl)-2,6-dimethoxybenzamide
CID 110776470
N-(4-acetylphenyl)-2-methoxy-4,6-dimethylbenzamide
CID 110764978
[(E)-3-[4-[(2,6-difluorobenzoyl)amino]phenyl]but-2-en-2-yl] acetate
CID 58992446
N-(4-amino-3-methoxyphenyl)-2,6-difluorobenzamide
CID 61240247
N-[4-[(2-fluorophenyl)methylamino]phenyl]-2,6-dimethoxybenzamide
CID 112982382
1-N-(4-acetylphenyl)-4-N-(4-fluorophenyl)benzene-1,4-dicarboxamide
CID 109049917
N-(4-iodophenyl)-2,6-dimethoxybenzamide
CID 1019212
2-N-(4-acetylphenyl)-6-N-(2-methoxyphenyl)pyridine-2,6-dicarboxamide
CID 109100922

Frequently Asked Questions

What is the IUPAC name of N-(4-acetylphenyl)-2-fluoro-6-methoxybenzamide?
The IUPAC name of N-(4-acetylphenyl)-2-fluoro-6-methoxybenzamide (CID 65434404) is N-(4-acetylphenyl)-2-fluoro-6-methoxybenzamide.
What is the SMILES notation for N-(4-acetylphenyl)-2-fluoro-6-methoxybenzamide?
The canonical SMILES for N-(4-acetylphenyl)-2-fluoro-6-methoxybenzamide is COc1cccc(F)c1C(=O)Nc1ccc(C(C)=O)cc1.
What is the InChIKey of N-(4-acetylphenyl)-2-fluoro-6-methoxybenzamide?
The InChIKey is PDDPWKWGRPOLAE-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14FNO3/c1-10(19)11-6-8-12(9-7-11)18-16(20)15-13(17)4-3-5-14(15)21-2/h3-9H,1-2H3,(H,18,20).
What are the key properties of N-(4-acetylphenyl)-2-fluoro-6-methoxybenzamide?
N-(4-acetylphenyl)-2-fluoro-6-methoxybenzamide has a molecular weight of 287.29 g/mol, XLogP of 3.29, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-acetylphenyl)-2-fluoro-6-methoxybenzamide is sourced from PubChem (CID 65434404), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).