3-(dimethylamino)-N-[(3-phenylmethoxyphenyl)methyl]benzamide

C23H24N2O2 — CID 52685710

IUPAC3-(dimethylamino)-N-[(3-phenylmethoxyphenyl)methyl]benzamide
SMILESCN(C)c1cccc(C(=O)NCc2cccc(OCc3ccccc3)c2)c1
InChIInChI=1S/C23H24N2O2/c1-25(2)21-12-7-11-20(15-21)23(26)24-16-19-10-6-13-22(14-19)27-17-18-8-4-3-5-9-18/h3-15H,16-17H2,1-2H3,(H,24,26)
InChIKeyIXUQGCQHLFDCHO-UHFFFAOYSA-N
MW360.46 g/mol
LogP4.26
Rot. Bonds7

About 3-(dimethylamino)-N-[(3-phenylmethoxyphenyl)methyl]benzamide

3-(dimethylamino)-N-[(3-phenylmethoxyphenyl)methyl]benzamide (PubChem CID 52685710) has the molecular formula C23H24N2O2 and a molecular weight of 360.46 g/mol. Its IUPAC name is 3-(dimethylamino)-N-[(3-phenylmethoxyphenyl)methyl]benzamide.

Molecular Properties

Compound Name3-(dimethylamino)-N-[(3-phenylmethoxyphenyl)methyl]benzamide
PubChem CID52685710
Molecular FormulaC23H24N2O2
Molecular Weight360.46 g/mol
Exact Mass360.18
IUPAC Name3-(dimethylamino)-N-[(3-phenylmethoxyphenyl)methyl]benzamide
SMILESCN(C)c1cccc(C(=O)NCc2cccc(OCc3ccccc3)c2)c1
InChIInChI=1S/C23H24N2O2/c1-25(2)21-12-7-11-20(15-21)23(26)24-16-19-10-6-13-22(14-19)27-17-18-8-4-3-5-9-18/h3-15H,16-17H2,1-2H3,(H,24,26)
InChIKeyIXUQGCQHLFDCHO-UHFFFAOYSA-N
XLogP4.26
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500360.46
LogP ≤ 54.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[[2-(dimethylamino)-4-pyridinyl]methyl]-3-phenylmethoxybenzamide
CID 55637639
N-[(3-methylphenyl)methyl]-3-phenylmethoxybenzamide
CID 50875108
4-(dimethylsulfamoyl)-N-[(3-phenylmethoxyphenyl)methyl]benzamide
CID 52685715
N-[(3-phenylmethoxyphenyl)methyl]-2H-benzotriazole-5-carboxamide
CID 60515368
3-[[[3-(dimethylamino)benzoyl]amino]methyl]benzamide
CID 32636517
N-[(3-chlorophenyl)methyl]-3-(dimethylamino)benzamide
CID 7922599
N-[4-(dimethylamino)phenyl]-3-phenylmethoxybenzamide
CID 23733067
3-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]-N-[(3-phenylmethoxyphenyl)methyl]benzamide
CID 55846787
N-benzyl-3-[(4-cyanophenyl)methoxy]benzamide
CID 7492266
3-(dimethylamino)-N-[[4-(hydroxymethyl)phenyl]methyl]benzamide
CID 107231911
N,N-dimethyl-3-phenylmethoxybenzamide
CID 8778645
N-[[3-[2-(4-phenoxyphenoxy)ethoxy]phenyl]methyl]benzamide
CID 173183648

Frequently Asked Questions

What is the IUPAC name of 3-(dimethylamino)-N-[(3-phenylmethoxyphenyl)methyl]benzamide?
The IUPAC name of 3-(dimethylamino)-N-[(3-phenylmethoxyphenyl)methyl]benzamide (CID 52685710) is 3-(dimethylamino)-N-[(3-phenylmethoxyphenyl)methyl]benzamide.
What is the SMILES notation for 3-(dimethylamino)-N-[(3-phenylmethoxyphenyl)methyl]benzamide?
The canonical SMILES for 3-(dimethylamino)-N-[(3-phenylmethoxyphenyl)methyl]benzamide is CN(C)c1cccc(C(=O)NCc2cccc(OCc3ccccc3)c2)c1.
What is the InChIKey of 3-(dimethylamino)-N-[(3-phenylmethoxyphenyl)methyl]benzamide?
The InChIKey is IXUQGCQHLFDCHO-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H24N2O2/c1-25(2)21-12-7-11-20(15-21)23(26)24-16-19-10-6-13-22(14-19)27-17-18-8-4-3-5-9-18/h3-15H,16-17H2,1-2H3,(H,24,26).
What are the key properties of 3-(dimethylamino)-N-[(3-phenylmethoxyphenyl)methyl]benzamide?
3-(dimethylamino)-N-[(3-phenylmethoxyphenyl)methyl]benzamide has a molecular weight of 360.46 g/mol, XLogP of 4.26, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(dimethylamino)-N-[(3-phenylmethoxyphenyl)methyl]benzamide is sourced from PubChem (CID 52685710), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).