4-[4-[(2,3-dimethylphenoxy)methyl]-2-pyridinyl]-N,2-dimethylbenzamide

C23H24N2O2 — CID 170054886

IUPAC4-[4-[(2,3-dimethylphenoxy)methyl]-2-pyridinyl]-N,2-dimethylbenzamide
SMILESCNC(=O)c1ccc(-c2cc(COc3cccc(C)c3C)ccn2)cc1C
InChIInChI=1S/C23H24N2O2/c1-15-6-5-7-22(17(15)3)27-14-18-10-11-25-21(13-18)19-8-9-20(16(2)12-19)23(26)24-4/h5-13H,14H2,1-4H3,(H,24,26)
InChIKeySGAKIDYAXNYWQZ-UHFFFAOYSA-N
MW360.46 g/mol
LogP4.61
Rot. Bonds5

About 4-[4-[(2,3-dimethylphenoxy)methyl]-2-pyridinyl]-N,2-dimethylbenzamide

4-[4-[(2,3-dimethylphenoxy)methyl]-2-pyridinyl]-N,2-dimethylbenzamide (PubChem CID 170054886) has the molecular formula C23H24N2O2 and a molecular weight of 360.46 g/mol. Its IUPAC name is 4-[4-[(2,3-dimethylphenoxy)methyl]-2-pyridinyl]-N,2-dimethylbenzamide.

Molecular Properties

Compound Name4-[4-[(2,3-dimethylphenoxy)methyl]-2-pyridinyl]-N,2-dimethylbenzamide
PubChem CID170054886
Molecular FormulaC23H24N2O2
Molecular Weight360.46 g/mol
Exact Mass360.18
IUPAC Name4-[4-[(2,3-dimethylphenoxy)methyl]-2-pyridinyl]-N,2-dimethylbenzamide
SMILESCNC(=O)c1ccc(-c2cc(COc3cccc(C)c3C)ccn2)cc1C
InChIInChI=1S/C23H24N2O2/c1-15-6-5-7-22(17(15)3)27-14-18-10-11-25-21(13-18)19-8-9-20(16(2)12-19)23(26)24-4/h5-13H,14H2,1-4H3,(H,24,26)
InChIKeySGAKIDYAXNYWQZ-UHFFFAOYSA-N
XLogP4.61
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500360.46
LogP ≤ 54.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 4-[4-[(2,3-dimethylphenoxy)methyl]-2-pyridinyl]-N,2-dimethylbenzamide 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

4-[4-[(4-chlorophenoxy)methyl]-2-pyridinyl]-N-iodo-2-methylbenzamide
CID 170054875
[2-(4-carbamoyl-3-methylphenyl)-4-pyridinyl]methyl acetate
CID 166793684
[4-[(2,3-dimethylphenoxy)methyl]-2-pyridinyl]hydrazine
CID 62466446
4-[4-[[3-(1,1-difluoroethyl)-1-methylpyrazol-5-yl]oxymethyl]-2-pyridinyl]-2-methylbenzohydrazide
CID 170055048
4-[4-(2,3-dihydro-1-benzofuran-5-yloxymethyl)-2-pyridinyl]-2-methylbenzohydrazide
CID 170055033
methyl 2-methyl-4-[4-[[3-(trifluoromethyl)phenyl]methyl]-2-pyridinyl]benzoate
CID 174214827
2-methyl-4-[4-[[3-(trifluoromethyl)phenyl]methyl]-2-pyridinyl]benzamide
CID 166100350
4-[4-[(4-chloro-3-fluorophenoxy)methyl]-2-pyridinyl]-2-methylbenzamide
CID 166793626
5-[(2,3-dimethylphenoxy)methyl]-2-methoxybenzoic acid
CID 65339710
4-[2-[(3,5-difluorophenoxy)methyl]-4-pyridinyl]-N,2-dimethylbenzamide
CID 170054463
2,4-dimethyl-N-[(2-pyridin-4-yl-4-pyridinyl)methyl]benzamide
CID 121165448
2-[(3,4-dichlorophenyl)methoxy]-N-methylbenzamide
CID 13073632

Frequently Asked Questions

What is the IUPAC name of 4-[4-[(2,3-dimethylphenoxy)methyl]-2-pyridinyl]-N,2-dimethylbenzamide?
The IUPAC name of 4-[4-[(2,3-dimethylphenoxy)methyl]-2-pyridinyl]-N,2-dimethylbenzamide (CID 170054886) is 4-[4-[(2,3-dimethylphenoxy)methyl]-2-pyridinyl]-N,2-dimethylbenzamide.
What is the SMILES notation for 4-[4-[(2,3-dimethylphenoxy)methyl]-2-pyridinyl]-N,2-dimethylbenzamide?
The canonical SMILES for 4-[4-[(2,3-dimethylphenoxy)methyl]-2-pyridinyl]-N,2-dimethylbenzamide is CNC(=O)c1ccc(-c2cc(COc3cccc(C)c3C)ccn2)cc1C.
What is the InChIKey of 4-[4-[(2,3-dimethylphenoxy)methyl]-2-pyridinyl]-N,2-dimethylbenzamide?
The InChIKey is SGAKIDYAXNYWQZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H24N2O2/c1-15-6-5-7-22(17(15)3)27-14-18-10-11-25-21(13-18)19-8-9-20(16(2)12-19)23(26)24-4/h5-13H,14H2,1-4H3,(H,24,26).
What are the key properties of 4-[4-[(2,3-dimethylphenoxy)methyl]-2-pyridinyl]-N,2-dimethylbenzamide?
4-[4-[(2,3-dimethylphenoxy)methyl]-2-pyridinyl]-N,2-dimethylbenzamide has a molecular weight of 360.46 g/mol, XLogP of 4.61, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[4-[(2,3-dimethylphenoxy)methyl]-2-pyridinyl]-N,2-dimethylbenzamide is sourced from PubChem (CID 170054886), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).