N-(2,6-difluorophenyl)-3-(3-methylphenyl)propanamide

C16H15F2NO — CID 51277484

IUPACN-(2,6-difluorophenyl)-3-(3-methylphenyl)propanamide
SMILESCc1cccc(CCC(=O)Nc2c(F)cccc2F)c1
InChIInChI=1S/C16H15F2NO/c1-11-4-2-5-12(10-11)8-9-15(20)19-16-13(17)6-3-7-14(16)18/h2-7,10H,8-9H2,1H3,(H,19,20)
InChIKeyMHWJQWROTJSLCR-UHFFFAOYSA-N
MW275.30 g/mol
LogP3.84
Rot. Bonds4

About N-(2,6-difluorophenyl)-3-(3-methylphenyl)propanamide

N-(2,6-difluorophenyl)-3-(3-methylphenyl)propanamide (PubChem CID 51277484) has the molecular formula C16H15F2NO and a molecular weight of 275.30 g/mol. Its IUPAC name is N-(2,6-difluorophenyl)-3-(3-methylphenyl)propanamide.

Molecular Properties

Compound NameN-(2,6-difluorophenyl)-3-(3-methylphenyl)propanamide
PubChem CID51277484
Molecular FormulaC16H15F2NO
Molecular Weight275.30 g/mol
Exact Mass275.11
IUPAC NameN-(2,6-difluorophenyl)-3-(3-methylphenyl)propanamide
SMILESCc1cccc(CCC(=O)Nc2c(F)cccc2F)c1
InChIInChI=1S/C16H15F2NO/c1-11-4-2-5-12(10-11)8-9-15(20)19-16-13(17)6-3-7-14(16)18/h2-7,10H,8-9H2,1H3,(H,19,20)
InChIKeyMHWJQWROTJSLCR-UHFFFAOYSA-N
XLogP3.84
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.30
LogP ≤ 53.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-(4-amino-2,6-dimethylphenyl)-3-(3-methylphenyl)propanamide
CID 79994081
3-(3,4-dichlorophenyl)-N-(2,6-difluorophenyl)propanamide
CID 99633619
N-(3-amino-2,6-dimethylphenyl)-3-(3-methylphenyl)propanamide
CID 62367240
N-(3-amino-5-fluorophenyl)-3-(3-methylphenyl)propanamide
CID 107333898
N-(2-hydroxy-4-methylphenyl)-3-(3-methylphenyl)propanamide
CID 47128848
N-(2-bromo-5-methylphenyl)-3-(3-methylphenyl)propanamide
CID 82706258
N-(3,5-dichloro-4-hydroxyphenyl)-3-(3-methylphenyl)propanamide
CID 82881123
N-(3,5-dimethoxyphenyl)-3-(3-methylphenyl)propanamide
CID 51276940
N-[4-(2-chloroethyl)phenyl]-3-(3-methylphenyl)propanamide
CID 114299156
N-(2-acetylphenyl)-3-(3-methylphenyl)propanamide
CID 60700220
3-(3-bromophenyl)-N-(2-fluoro-5-methylphenyl)propanamide
CID 42990299
N-(2-amino-5-chlorophenyl)-3-(3-methylphenyl)propanamide
CID 62366718

Frequently Asked Questions

What is the IUPAC name of N-(2,6-difluorophenyl)-3-(3-methylphenyl)propanamide?
The IUPAC name of N-(2,6-difluorophenyl)-3-(3-methylphenyl)propanamide (CID 51277484) is N-(2,6-difluorophenyl)-3-(3-methylphenyl)propanamide.
What is the SMILES notation for N-(2,6-difluorophenyl)-3-(3-methylphenyl)propanamide?
The canonical SMILES for N-(2,6-difluorophenyl)-3-(3-methylphenyl)propanamide is Cc1cccc(CCC(=O)Nc2c(F)cccc2F)c1.
What is the InChIKey of N-(2,6-difluorophenyl)-3-(3-methylphenyl)propanamide?
The InChIKey is MHWJQWROTJSLCR-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15F2NO/c1-11-4-2-5-12(10-11)8-9-15(20)19-16-13(17)6-3-7-14(16)18/h2-7,10H,8-9H2,1H3,(H,19,20).
What are the key properties of N-(2,6-difluorophenyl)-3-(3-methylphenyl)propanamide?
N-(2,6-difluorophenyl)-3-(3-methylphenyl)propanamide has a molecular weight of 275.30 g/mol, XLogP of 3.84, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,6-difluorophenyl)-3-(3-methylphenyl)propanamide is sourced from PubChem (CID 51277484), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).