3-(dimethylamino)-N-(2-fluoro-4-methylphenyl)benzamide

C16H17FN2O — CID 26522946

IUPAC3-(dimethylamino)-N-(2-fluoro-4-methylphenyl)benzamide
SMILESCc1ccc(NC(=O)c2cccc(N(C)C)c2)c(F)c1
InChIInChI=1S/C16H17FN2O/c1-11-7-8-15(14(17)9-11)18-16(20)12-5-4-6-13(10-12)19(2)3/h4-10H,1-3H3,(H,18,20)
InChIKeyATJYNUSVAKGBKO-UHFFFAOYSA-N
MW272.32 g/mol
LogP3.45
Rot. Bonds3

About 3-(dimethylamino)-N-(2-fluoro-4-methylphenyl)benzamide

3-(dimethylamino)-N-(2-fluoro-4-methylphenyl)benzamide (PubChem CID 26522946) has the molecular formula C16H17FN2O and a molecular weight of 272.32 g/mol. Its IUPAC name is 3-(dimethylamino)-N-(2-fluoro-4-methylphenyl)benzamide.

Molecular Properties

Compound Name3-(dimethylamino)-N-(2-fluoro-4-methylphenyl)benzamide
PubChem CID26522946
Molecular FormulaC16H17FN2O
Molecular Weight272.32 g/mol
Exact Mass272.13
IUPAC Name3-(dimethylamino)-N-(2-fluoro-4-methylphenyl)benzamide
SMILESCc1ccc(NC(=O)c2cccc(N(C)C)c2)c(F)c1
InChIInChI=1S/C16H17FN2O/c1-11-7-8-15(14(17)9-11)18-16(20)12-5-4-6-13(10-12)19(2)3/h4-10H,1-3H3,(H,18,20)
InChIKeyATJYNUSVAKGBKO-UHFFFAOYSA-N
XLogP3.45
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.32
LogP ≤ 53.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 3-(dimethylamino)-N-(2-fluoro-4-methylphenyl)benzamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3-(dimethylamino)-N-(2,4-dimethylphenyl)benzamide
CID 2081678
3-(dimethylamino)-N-(4-methylphenyl)benzamide
CID 7899886
N-(2-fluoro-4-methylphenyl)-3-(trifluoromethyl)benzamide
CID 26522930
N-(2-fluoro-4-iodophenyl)-3-methylbenzamide
CID 17102075
4-fluoro-N-(2-fluoro-4-methylphenyl)-3-methylbenzamide
CID 55163065
N-(2,4-difluorophenyl)-3-[methyl(methylsulfonyl)amino]benzamide
CID 47001427
N-(3-amino-2-methylphenyl)-3-(dimethylamino)benzamide
CID 43146782
N-(2,5-dichlorophenyl)-3-(dimethylamino)benzamide
CID 690506
3-(2,5-dioxopyrrolidin-1-yl)-N-(2-fluoro-4-methylphenyl)benzamide
CID 18166253
4-(dimethylamino)-N-(2-fluoro-5-methylphenyl)benzamide
CID 78769182
2,3-difluoro-N-(2-fluoro-4-methylphenyl)benzamide
CID 62648850
3-(ethylsulfamoyl)-N-(2-fluoro-4-methylphenyl)benzamide
CID 26698365

Frequently Asked Questions

What is the IUPAC name of 3-(dimethylamino)-N-(2-fluoro-4-methylphenyl)benzamide?
The IUPAC name of 3-(dimethylamino)-N-(2-fluoro-4-methylphenyl)benzamide (CID 26522946) is 3-(dimethylamino)-N-(2-fluoro-4-methylphenyl)benzamide.
What is the SMILES notation for 3-(dimethylamino)-N-(2-fluoro-4-methylphenyl)benzamide?
The canonical SMILES for 3-(dimethylamino)-N-(2-fluoro-4-methylphenyl)benzamide is Cc1ccc(NC(=O)c2cccc(N(C)C)c2)c(F)c1.
What is the InChIKey of 3-(dimethylamino)-N-(2-fluoro-4-methylphenyl)benzamide?
The InChIKey is ATJYNUSVAKGBKO-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17FN2O/c1-11-7-8-15(14(17)9-11)18-16(20)12-5-4-6-13(10-12)19(2)3/h4-10H,1-3H3,(H,18,20).
What are the key properties of 3-(dimethylamino)-N-(2-fluoro-4-methylphenyl)benzamide?
3-(dimethylamino)-N-(2-fluoro-4-methylphenyl)benzamide has a molecular weight of 272.32 g/mol, XLogP of 3.45, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(dimethylamino)-N-(2-fluoro-4-methylphenyl)benzamide is sourced from PubChem (CID 26522946), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).