N-[2-(ethoxymethyl)phenyl]-2-fluoro-5-methylbenzamide

C17H18FNO2 — CID 62511294

IUPACN-[2-(ethoxymethyl)phenyl]-2-fluoro-5-methylbenzamide
SMILESCCOCc1ccccc1NC(=O)c1cc(C)ccc1F
InChIInChI=1S/C17H18FNO2/c1-3-21-11-13-6-4-5-7-16(13)19-17(20)14-10-12(2)8-9-15(14)18/h4-10H,3,11H2,1-2H3,(H,19,20)
InChIKeyQZLRVKBWSLFNDS-UHFFFAOYSA-N
MW287.33 g/mol
LogP3.92
Rot. Bonds5

About N-[2-(ethoxymethyl)phenyl]-2-fluoro-5-methylbenzamide

N-[2-(ethoxymethyl)phenyl]-2-fluoro-5-methylbenzamide (PubChem CID 62511294) has the molecular formula C17H18FNO2 and a molecular weight of 287.33 g/mol. Its IUPAC name is N-[2-(ethoxymethyl)phenyl]-2-fluoro-5-methylbenzamide.

Molecular Properties

Compound NameN-[2-(ethoxymethyl)phenyl]-2-fluoro-5-methylbenzamide
PubChem CID62511294
Molecular FormulaC17H18FNO2
Molecular Weight287.33 g/mol
Exact Mass287.13
IUPAC NameN-[2-(ethoxymethyl)phenyl]-2-fluoro-5-methylbenzamide
SMILESCCOCc1ccccc1NC(=O)c1cc(C)ccc1F
InChIInChI=1S/C17H18FNO2/c1-3-21-11-13-6-4-5-7-16(13)19-17(20)14-10-12(2)8-9-15(14)18/h4-10H,3,11H2,1-2H3,(H,19,20)
InChIKeyQZLRVKBWSLFNDS-UHFFFAOYSA-N
XLogP3.92
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.33
LogP ≤ 53.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-fluoro-N-[2-(methoxymethyl)phenyl]-5-methylbenzamide
CID 62511821
N-[2-(ethoxymethyl)phenyl]-2,4-dimethylbenzamide
CID 86821681
2-fluoro-4-methyl-N-(2-propylphenyl)benzamide
CID 79778827
N-(2-chlorophenyl)-2-fluoro-5-methylbenzamide
CID 62509353
2-(ethoxymethyl)-N-[(2-fluoro-5-methylphenyl)methyl]aniline
CID 103720558
N-[2-(ethoxymethyl)phenyl]-3,4-dimethylbenzamide
CID 86821684
2-[(2-fluoro-5-methylbenzoyl)amino]-5-methylbenzoic acid
CID 62515827
4-chloro-N-[2-(ethoxymethyl)phenyl]-6-methylpyridine-3-carboxamide
CID 81227998
2-fluoro-N-[2-(N'-hydroxycarbamimidoyl)phenyl]-5-methylbenzamide
CID 76945644
2-fluoro-N-(3-hydroxy-2-methylphenyl)-5-methylbenzamide
CID 64794363
2-(2,5-dimethylphenoxy)-N-[2-(ethoxymethyl)phenyl]acetamide
CID 86821690
N-(2-ethylphenyl)-2,4-dimethylbenzamide
CID 953221

Frequently Asked Questions

What is the IUPAC name of N-[2-(ethoxymethyl)phenyl]-2-fluoro-5-methylbenzamide?
The IUPAC name of N-[2-(ethoxymethyl)phenyl]-2-fluoro-5-methylbenzamide (CID 62511294) is N-[2-(ethoxymethyl)phenyl]-2-fluoro-5-methylbenzamide.
What is the SMILES notation for N-[2-(ethoxymethyl)phenyl]-2-fluoro-5-methylbenzamide?
The canonical SMILES for N-[2-(ethoxymethyl)phenyl]-2-fluoro-5-methylbenzamide is CCOCc1ccccc1NC(=O)c1cc(C)ccc1F.
What is the InChIKey of N-[2-(ethoxymethyl)phenyl]-2-fluoro-5-methylbenzamide?
The InChIKey is QZLRVKBWSLFNDS-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18FNO2/c1-3-21-11-13-6-4-5-7-16(13)19-17(20)14-10-12(2)8-9-15(14)18/h4-10H,3,11H2,1-2H3,(H,19,20).
What are the key properties of N-[2-(ethoxymethyl)phenyl]-2-fluoro-5-methylbenzamide?
N-[2-(ethoxymethyl)phenyl]-2-fluoro-5-methylbenzamide has a molecular weight of 287.33 g/mol, XLogP of 3.92, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(ethoxymethyl)phenyl]-2-fluoro-5-methylbenzamide is sourced from PubChem (CID 62511294), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).