N-(2-fluoro-4-methylphenyl)-2,2-dimethylpropanamide

C12H16FNO — CID 24898894

IUPACN-(2-fluoro-4-methylphenyl)-2,2-dimethylpropanamide
SMILESCc1ccc(NC(=O)C(C)(C)C)c(F)c1
InChIInChI=1S/C12H16FNO/c1-8-5-6-10(9(13)7-8)14-11(15)12(2,3)4/h5-7H,1-4H3,(H,14,15)
InChIKeyQNQMNOFBFKHOKX-UHFFFAOYSA-N
MW209.26 g/mol
LogP3.12
Rot. Bonds1

About N-(2-fluoro-4-methylphenyl)-2,2-dimethylpropanamide

N-(2-fluoro-4-methylphenyl)-2,2-dimethylpropanamide (PubChem CID 24898894) has the molecular formula C12H16FNO and a molecular weight of 209.26 g/mol. Its IUPAC name is N-(2-fluoro-4-methylphenyl)-2,2-dimethylpropanamide.

Molecular Properties

Compound NameN-(2-fluoro-4-methylphenyl)-2,2-dimethylpropanamide
PubChem CID24898894
Molecular FormulaC12H16FNO
Molecular Weight209.26 g/mol
Exact Mass209.12
IUPAC NameN-(2-fluoro-4-methylphenyl)-2,2-dimethylpropanamide
SMILESCc1ccc(NC(=O)C(C)(C)C)c(F)c1
InChIInChI=1S/C12H16FNO/c1-8-5-6-10(9(13)7-8)14-11(15)12(2,3)4/h5-7H,1-4H3,(H,14,15)
InChIKeyQNQMNOFBFKHOKX-UHFFFAOYSA-N
XLogP3.12
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.26
LogP ≤ 53.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-(2-fluoro-4-methylphenyl)-2-methyl-2-(methylamino)propanamide
CID 62835057
3-amino-N-(2-fluoro-4-methylphenyl)-2,2,3-trimethylbutanamide
CID 65264934
2,2,3,3,3-pentafluoro-N-(2-fluoro-4-methylphenyl)propanamide
CID 114038112
N-(2-fluoro-4-hydroxyphenyl)-2,2-dimethylpropanamide
CID 64795167
N-(2-iodo-4-methylphenyl)-2,2-dimethylpropanamide
CID 532037
N-(4-ethynyl-2-fluorophenyl)-2,2-dimethylpropanamide
CID 139782044
(2S)-2-amino-N-(2-fluoro-4-methylphenyl)-3,3-dimethylbutanamide
CID 61148813
N-(2-fluoro-4-methylphenyl)propanamide
CID 60628124
N-[4-(2,2-dibromoethenyl)-2-fluorophenyl]-2,2-dimethylpropanamide
CID 139782056
2-chloro-N-(2-fluoro-4-methylphenyl)acetamide
CID 2497550
2-(2-fluoro-4-methylanilino)-2-methylpropanoic acid
CID 82236350
N-(2-bromo-4-methylphenyl)-N'-(2-fluorophenyl)-2,2-dimethylpropanediamide
CID 108968743

Frequently Asked Questions

What is the IUPAC name of N-(2-fluoro-4-methylphenyl)-2,2-dimethylpropanamide?
The IUPAC name of N-(2-fluoro-4-methylphenyl)-2,2-dimethylpropanamide (CID 24898894) is N-(2-fluoro-4-methylphenyl)-2,2-dimethylpropanamide.
What is the SMILES notation for N-(2-fluoro-4-methylphenyl)-2,2-dimethylpropanamide?
The canonical SMILES for N-(2-fluoro-4-methylphenyl)-2,2-dimethylpropanamide is Cc1ccc(NC(=O)C(C)(C)C)c(F)c1.
What is the InChIKey of N-(2-fluoro-4-methylphenyl)-2,2-dimethylpropanamide?
The InChIKey is QNQMNOFBFKHOKX-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16FNO/c1-8-5-6-10(9(13)7-8)14-11(15)12(2,3)4/h5-7H,1-4H3,(H,14,15).
What are the key properties of N-(2-fluoro-4-methylphenyl)-2,2-dimethylpropanamide?
N-(2-fluoro-4-methylphenyl)-2,2-dimethylpropanamide has a molecular weight of 209.26 g/mol, XLogP of 3.12, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-fluoro-4-methylphenyl)-2,2-dimethylpropanamide is sourced from PubChem (CID 24898894), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).