N-(2-ethyl-6-methylphenyl)-4-fluoro-2-methylbenzamide

C17H18FNO — CID 115573702

IUPACN-(2-ethyl-6-methylphenyl)-4-fluoro-2-methylbenzamide
SMILESCCc1cccc(C)c1NC(=O)c1ccc(F)cc1C
InChIInChI=1S/C17H18FNO/c1-4-13-7-5-6-11(2)16(13)19-17(20)15-9-8-14(18)10-12(15)3/h5-10H,4H2,1-3H3,(H,19,20)
InChIKeyUHPWTYYMNSBPST-UHFFFAOYSA-N
MW271.33 g/mol
LogP4.26
Rot. Bonds3

About N-(2-ethyl-6-methylphenyl)-4-fluoro-2-methylbenzamide

N-(2-ethyl-6-methylphenyl)-4-fluoro-2-methylbenzamide (PubChem CID 115573702) has the molecular formula C17H18FNO and a molecular weight of 271.33 g/mol. Its IUPAC name is N-(2-ethyl-6-methylphenyl)-4-fluoro-2-methylbenzamide.

Molecular Properties

Compound NameN-(2-ethyl-6-methylphenyl)-4-fluoro-2-methylbenzamide
PubChem CID115573702
Molecular FormulaC17H18FNO
Molecular Weight271.33 g/mol
Exact Mass271.14
IUPAC NameN-(2-ethyl-6-methylphenyl)-4-fluoro-2-methylbenzamide
SMILESCCc1cccc(C)c1NC(=O)c1ccc(F)cc1C
InChIInChI=1S/C17H18FNO/c1-4-13-7-5-6-11(2)16(13)19-17(20)15-9-8-14(18)10-12(15)3/h5-10H,4H2,1-3H3,(H,19,20)
InChIKeyUHPWTYYMNSBPST-UHFFFAOYSA-N
XLogP4.26
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.33
LogP ≤ 54.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-bromo-N-(2-ethyl-6-methylphenyl)-5-fluorobenzamide
CID 24693167
N-(2-chloro-6-methylphenyl)-4-fluoro-2-methylbenzamide
CID 113219145
N-(2,6-diethylphenyl)-2,4-difluorobenzamide
CID 2495338
1-(2,4-difluorophenyl)-3-(2-ethyl-6-methylphenyl)urea
CID 108991584
2,4-dichloro-N-(2-ethyl-6-methylphenyl)benzamide
CID 779360
4-fluoro-2-methyl-N-(2-propylphenyl)benzamide
CID 115745651
N-(2-ethyl-6-methylphenyl)-6-methyl-4-oxo-1H-pyridine-3-carboxamide
CID 110858010
N-(2-ethyl-6-methylphenyl)-2,4,5-trimethoxybenzamide
CID 2665532
N'-(2-ethyl-6-methylphenyl)-N-(3-fluorophenyl)propanediamide
CID 108954227
3-(2,5-difluorophenyl)-N-(2-ethyl-6-methylphenyl)propanamide
CID 60564582
N-(2-ethyl-6-methylphenyl)-2-[(4-fluoro-2-methylphenyl)sulfonylamino]acetamide
CID 112997050
N,N'-bis(2-ethyl-6-methylphenyl)oxamide
CID 3725747

Frequently Asked Questions

What is the IUPAC name of N-(2-ethyl-6-methylphenyl)-4-fluoro-2-methylbenzamide?
The IUPAC name of N-(2-ethyl-6-methylphenyl)-4-fluoro-2-methylbenzamide (CID 115573702) is N-(2-ethyl-6-methylphenyl)-4-fluoro-2-methylbenzamide.
What is the SMILES notation for N-(2-ethyl-6-methylphenyl)-4-fluoro-2-methylbenzamide?
The canonical SMILES for N-(2-ethyl-6-methylphenyl)-4-fluoro-2-methylbenzamide is CCc1cccc(C)c1NC(=O)c1ccc(F)cc1C.
What is the InChIKey of N-(2-ethyl-6-methylphenyl)-4-fluoro-2-methylbenzamide?
The InChIKey is UHPWTYYMNSBPST-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18FNO/c1-4-13-7-5-6-11(2)16(13)19-17(20)15-9-8-14(18)10-12(15)3/h5-10H,4H2,1-3H3,(H,19,20).
What are the key properties of N-(2-ethyl-6-methylphenyl)-4-fluoro-2-methylbenzamide?
N-(2-ethyl-6-methylphenyl)-4-fluoro-2-methylbenzamide has a molecular weight of 271.33 g/mol, XLogP of 4.26, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-ethyl-6-methylphenyl)-4-fluoro-2-methylbenzamide is sourced from PubChem (CID 115573702), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).