3-(dimethylamino)-N-(2,4-dimethylphenyl)benzamide

C17H20N2O — CID 2081678

IUPAC3-(dimethylamino)-N-(2,4-dimethylphenyl)benzamide
SMILESCc1ccc(NC(=O)c2cccc(N(C)C)c2)c(C)c1
InChIInChI=1S/C17H20N2O/c1-12-8-9-16(13(2)10-12)18-17(20)14-6-5-7-15(11-14)19(3)4/h5-11H,1-4H3,(H,18,20)
InChIKeyGLFRCRJCSARAMK-UHFFFAOYSA-N
MW268.36 g/mol
LogP3.62
Rot. Bonds3

About 3-(dimethylamino)-N-(2,4-dimethylphenyl)benzamide

3-(dimethylamino)-N-(2,4-dimethylphenyl)benzamide (PubChem CID 2081678) has the molecular formula C17H20N2O and a molecular weight of 268.36 g/mol. Its IUPAC name is 3-(dimethylamino)-N-(2,4-dimethylphenyl)benzamide.

Molecular Properties

Compound Name3-(dimethylamino)-N-(2,4-dimethylphenyl)benzamide
PubChem CID2081678
Molecular FormulaC17H20N2O
Molecular Weight268.36 g/mol
Exact Mass268.16
IUPAC Name3-(dimethylamino)-N-(2,4-dimethylphenyl)benzamide
SMILESCc1ccc(NC(=O)c2cccc(N(C)C)c2)c(C)c1
InChIInChI=1S/C17H20N2O/c1-12-8-9-16(13(2)10-12)18-17(20)14-6-5-7-15(11-14)19(3)4/h5-11H,1-4H3,(H,18,20)
InChIKeyGLFRCRJCSARAMK-UHFFFAOYSA-N
XLogP3.62
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.36
LogP ≤ 53.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-(dimethylamino)-N-(2-fluoro-4-methylphenyl)benzamide
CID 26522946
3-(dimethylamino)-N-(4-methylphenyl)benzamide
CID 7899886
3-(dimethylamino)-N-(2-methyl-4-pyrrolidin-1-ylphenyl)benzamide
CID 42157817
N-(2,4-dimethylphenyl)-4-methylbenzamide
CID 774370
N-(3-amino-2-methylphenyl)-3-(dimethylamino)benzamide
CID 43146782
1-N-(2,4-dimethylphenyl)-3-N-(2-methoxy-5-methylphenyl)benzene-1,3-dicarboxamide
CID 109057155
1-N-(4-acetylphenyl)-3-N-(2,4-dimethylphenyl)benzene-1,3-dicarboxamide
CID 109057157
N-(4-fluoro-2-methylphenyl)-3-methylbenzamide
CID 2550656
3-(dimethylamino)-N-(4,5-dimethylthiophen-2-yl)benzamide
CID 110660161
N-(2,5-dichlorophenyl)-3-(dimethylamino)benzamide
CID 690506
4-amino-N-[4-(dimethylamino)-2-methylphenyl]benzamide
CID 43700590
6-(dimethylamino)-N-(2,4-dimethylphenyl)pyridine-2-carboxamide
CID 84575312

Frequently Asked Questions

What is the IUPAC name of 3-(dimethylamino)-N-(2,4-dimethylphenyl)benzamide?
The IUPAC name of 3-(dimethylamino)-N-(2,4-dimethylphenyl)benzamide (CID 2081678) is 3-(dimethylamino)-N-(2,4-dimethylphenyl)benzamide.
What is the SMILES notation for 3-(dimethylamino)-N-(2,4-dimethylphenyl)benzamide?
The canonical SMILES for 3-(dimethylamino)-N-(2,4-dimethylphenyl)benzamide is Cc1ccc(NC(=O)c2cccc(N(C)C)c2)c(C)c1.
What is the InChIKey of 3-(dimethylamino)-N-(2,4-dimethylphenyl)benzamide?
The InChIKey is GLFRCRJCSARAMK-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N2O/c1-12-8-9-16(13(2)10-12)18-17(20)14-6-5-7-15(11-14)19(3)4/h5-11H,1-4H3,(H,18,20).
What are the key properties of 3-(dimethylamino)-N-(2,4-dimethylphenyl)benzamide?
3-(dimethylamino)-N-(2,4-dimethylphenyl)benzamide has a molecular weight of 268.36 g/mol, XLogP of 3.62, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(dimethylamino)-N-(2,4-dimethylphenyl)benzamide is sourced from PubChem (CID 2081678), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).