N-(2,6-dimethylphenyl)-2-fluorobenzamide

C15H14FNO — CID 4097270

IUPACN-(2,6-dimethylphenyl)-2-fluorobenzamide
SMILESCc1cccc(C)c1NC(=O)c1ccccc1F
InChIInChI=1S/C15H14FNO/c1-10-6-5-7-11(2)14(10)17-15(18)12-8-3-4-9-13(12)16/h3-9H,1-2H3,(H,17,18)
InChIKeyYMURIJQFMSXAJF-UHFFFAOYSA-N
MW243.28 g/mol
LogP3.69
Rot. Bonds2

About N-(2,6-dimethylphenyl)-2-fluorobenzamide

N-(2,6-dimethylphenyl)-2-fluorobenzamide (PubChem CID 4097270) has the molecular formula C15H14FNO and a molecular weight of 243.28 g/mol. Its IUPAC name is N-(2,6-dimethylphenyl)-2-fluorobenzamide.

Molecular Properties

Compound NameN-(2,6-dimethylphenyl)-2-fluorobenzamide
PubChem CID4097270
Molecular FormulaC15H14FNO
Molecular Weight243.28 g/mol
Exact Mass243.11
IUPAC NameN-(2,6-dimethylphenyl)-2-fluorobenzamide
SMILESCc1cccc(C)c1NC(=O)c1ccccc1F
InChIInChI=1S/C15H14FNO/c1-10-6-5-7-11(2)14(10)17-15(18)12-8-3-4-9-13(12)16/h3-9H,1-2H3,(H,17,18)
InChIKeyYMURIJQFMSXAJF-UHFFFAOYSA-N
XLogP3.69
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.28
LogP ≤ 53.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-fluoro-N-(2-fluoro-6-methylphenyl)benzamide
CID 115909344
N-[(2S)-1-(2,6-dimethylanilino)-1-oxopropan-2-yl]-2-fluorobenzamide
CID 51606045
2-[(2-fluorobenzoyl)amino]-3-methyl-N-(1-methylpyrazol-3-yl)benzamide
CID 71938716
4-bromo-N-(2,6-dimethylphenyl)-2-fluorobenzamide
CID 18089577
N-(3-anilinopropyl)-2-[(2-fluorobenzoyl)amino]-3-methylbenzamide
CID 86905072
N-[4-[1-(2,6-dimethylanilino)-1-oxopropan-2-yl]sulfanylphenyl]-2-fluorobenzamide
CID 22777805
N-[1-[(2,6-dimethylphenyl)carbamoyl]cyclohexyl]-2-fluorobenzamide
CID 1494005
1-(2,6-difluorophenyl)-3-(2,6-dimethylphenyl)urea
CID 108991420
2-fluoro-N-(4-hydroxy-2-methylphenyl)benzamide
CID 1234575
2-[(2-fluoro-5-methylbenzoyl)amino]-3-methylbenzoic acid
CID 62515133
2-[(2-fluorobenzoyl)amino]-N-[(4-hydroxypyrrolidin-3-yl)methyl]-3-methylbenzamide;hydrochloride
CID 120945848
N-[2-(2,6-dimethylanilino)-1-(furan-2-yl)-2-oxoethyl]-2-fluorobenzamide
CID 3308582

Frequently Asked Questions

What is the IUPAC name of N-(2,6-dimethylphenyl)-2-fluorobenzamide?
The IUPAC name of N-(2,6-dimethylphenyl)-2-fluorobenzamide (CID 4097270) is N-(2,6-dimethylphenyl)-2-fluorobenzamide.
What is the SMILES notation for N-(2,6-dimethylphenyl)-2-fluorobenzamide?
The canonical SMILES for N-(2,6-dimethylphenyl)-2-fluorobenzamide is Cc1cccc(C)c1NC(=O)c1ccccc1F.
What is the InChIKey of N-(2,6-dimethylphenyl)-2-fluorobenzamide?
The InChIKey is YMURIJQFMSXAJF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14FNO/c1-10-6-5-7-11(2)14(10)17-15(18)12-8-3-4-9-13(12)16/h3-9H,1-2H3,(H,17,18).
What are the key properties of N-(2,6-dimethylphenyl)-2-fluorobenzamide?
N-(2,6-dimethylphenyl)-2-fluorobenzamide has a molecular weight of 243.28 g/mol, XLogP of 3.69, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,6-dimethylphenyl)-2-fluorobenzamide is sourced from PubChem (CID 4097270), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).