N-ethyl-4-fluoro-2-methyl-N-(3-methylphenyl)benzamide

C17H18FNO — CID 115745612

IUPACN-ethyl-4-fluoro-2-methyl-N-(3-methylphenyl)benzamide
SMILESCCN(C(=O)c1ccc(F)cc1C)c1cccc(C)c1
InChIInChI=1S/C17H18FNO/c1-4-19(15-7-5-6-12(2)10-15)17(20)16-9-8-14(18)11-13(16)3/h5-11H,4H2,1-3H3
InChIKeyAJXSNJCURNDEBJ-UHFFFAOYSA-N
MW271.34 g/mol
LogP4.11
Rot. Bonds3

About N-ethyl-4-fluoro-2-methyl-N-(3-methylphenyl)benzamide

N-ethyl-4-fluoro-2-methyl-N-(3-methylphenyl)benzamide (PubChem CID 115745612) has the molecular formula C17H18FNO and a molecular weight of 271.34 g/mol. Its IUPAC name is N-ethyl-4-fluoro-2-methyl-N-(3-methylphenyl)benzamide.

Molecular Properties

Compound NameN-ethyl-4-fluoro-2-methyl-N-(3-methylphenyl)benzamide
PubChem CID115745612
Molecular FormulaC17H18FNO
Molecular Weight271.34 g/mol
Exact Mass271.14
IUPAC NameN-ethyl-4-fluoro-2-methyl-N-(3-methylphenyl)benzamide
SMILESCCN(C(=O)c1ccc(F)cc1C)c1cccc(C)c1
InChIInChI=1S/C17H18FNO/c1-4-19(15-7-5-6-12(2)10-15)17(20)16-9-8-14(18)11-13(16)3/h5-11H,4H2,1-3H3
InChIKeyAJXSNJCURNDEBJ-UHFFFAOYSA-N
XLogP4.11
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.34
LogP ≤ 54.11
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

N-ethyl-2-fluoro-N-(3-fluorophenyl)-4-methylbenzamide
CID 79769914
N-ethyl-4-hydroxy-N-(3-hydroxyphenyl)-2-methylbenzamide
CID 107735686
N,4-diethyl-N-(3-methylphenyl)benzamide
CID 533234
2-bromo-N-ethyl-N-(3-methylphenyl)-5-sulfanylbenzamide
CID 107023751
1-N,1-N,4-N-triethyl-4-N-(3-methylphenyl)benzene-1,4-dicarboxamide
CID 109048470
N-ethyl-N-(3-methylphenyl)-4-sulfanylbenzamide
CID 107023760
N-ethyl-3-fluoro-2-hydrazinyl-N-(3-methylphenyl)benzamide
CID 62660273
N-ethyl-5-fluoro-3-methyl-N-(3-methylphenyl)-1H-indole-2-carboxamide
CID 113204665
2-chloro-N-ethyl-4-fluoro-N-(3-hydroxyphenyl)benzamide
CID 107736178
N-ethyl-4-fluoro-N-(3-fluorophenyl)-3-methylbenzamide
CID 63213412
N'-ethyl-N-[(4-fluorophenyl)methyl]-N'-(3-methylphenyl)oxamide
CID 108530671
N-ethyl-N-(3-methylphenyl)carbamoyl chloride
CID 79001605

Frequently Asked Questions

What is the IUPAC name of N-ethyl-4-fluoro-2-methyl-N-(3-methylphenyl)benzamide?
The IUPAC name of N-ethyl-4-fluoro-2-methyl-N-(3-methylphenyl)benzamide (CID 115745612) is N-ethyl-4-fluoro-2-methyl-N-(3-methylphenyl)benzamide.
What is the SMILES notation for N-ethyl-4-fluoro-2-methyl-N-(3-methylphenyl)benzamide?
The canonical SMILES for N-ethyl-4-fluoro-2-methyl-N-(3-methylphenyl)benzamide is CCN(C(=O)c1ccc(F)cc1C)c1cccc(C)c1.
What is the InChIKey of N-ethyl-4-fluoro-2-methyl-N-(3-methylphenyl)benzamide?
The InChIKey is AJXSNJCURNDEBJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18FNO/c1-4-19(15-7-5-6-12(2)10-15)17(20)16-9-8-14(18)11-13(16)3/h5-11H,4H2,1-3H3.
What are the key properties of N-ethyl-4-fluoro-2-methyl-N-(3-methylphenyl)benzamide?
N-ethyl-4-fluoro-2-methyl-N-(3-methylphenyl)benzamide has a molecular weight of 271.34 g/mol, XLogP of 4.11, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-4-fluoro-2-methyl-N-(3-methylphenyl)benzamide is sourced from PubChem (CID 115745612), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).