3-[[[3-[(3-methylphenyl)methoxy]benzoyl]amino]methyl]benzamide

C23H22N2O3 — CID 33097042

IUPAC3-[[[3-[(3-methylphenyl)methoxy]benzoyl]amino]methyl]benzamide
SMILESCc1cccc(COc2cccc(C(=O)NCc3cccc(C(N)=O)c3)c2)c1
InChIInChI=1S/C23H22N2O3/c1-16-5-2-7-18(11-16)15-28-21-10-4-9-20(13-21)23(27)25-14-17-6-3-8-19(12-17)22(24)26/h2-13H,14-15H2,1H3,(H2,24,26)(H,25,27)
InChIKeyYXZKHOKCJFRGBQ-UHFFFAOYSA-N
MW374.44 g/mol
LogP3.60
Rot. Bonds7

About 3-[[[3-[(3-methylphenyl)methoxy]benzoyl]amino]methyl]benzamide

3-[[[3-[(3-methylphenyl)methoxy]benzoyl]amino]methyl]benzamide (PubChem CID 33097042) has the molecular formula C23H22N2O3 and a molecular weight of 374.44 g/mol. Its IUPAC name is 3-[[[3-[(3-methylphenyl)methoxy]benzoyl]amino]methyl]benzamide.

Molecular Properties

Compound Name3-[[[3-[(3-methylphenyl)methoxy]benzoyl]amino]methyl]benzamide
PubChem CID33097042
Molecular FormulaC23H22N2O3
Molecular Weight374.44 g/mol
Exact Mass374.16
IUPAC Name3-[[[3-[(3-methylphenyl)methoxy]benzoyl]amino]methyl]benzamide
SMILESCc1cccc(COc2cccc(C(=O)NCc3cccc(C(N)=O)c3)c2)c1
InChIInChI=1S/C23H22N2O3/c1-16-5-2-7-18(11-16)15-28-21-10-4-9-20(13-21)23(27)25-14-17-6-3-8-19(12-17)22(24)26/h2-13H,14-15H2,1H3,(H2,24,26)(H,25,27)
InChIKeyYXZKHOKCJFRGBQ-UHFFFAOYSA-N
XLogP3.60
TPSA81.42 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500374.44
LogP ≤ 53.60
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(3-methylphenyl)methyl]-3-phenylmethoxybenzamide
CID 50875108
3-[[[2-(3-methylphenoxy)acetyl]amino]methyl]benzamide
CID 32636546
N-[(1,5-dimethylpyrrol-2-yl)methyl]-3-[(3-methylphenyl)methoxy]benzamide
CID 32619190
N-[(3-ethoxyphenyl)methyl]-3-methylbenzamide
CID 28572765
3-[[(3-phenoxybenzoyl)amino]methyl]benzamide
CID 32636499
N-(3-amino-2-methylpropyl)-3-[(3-methylphenyl)methoxy]benzamide;hydrochloride
CID 119995953
N-[2-(ethylamino)ethyl]-3-[(3-methylphenyl)methoxy]benzamide;hydrochloride
CID 119508535
methyl 2-methyl-5-[[[3-[(3-methylphenyl)methoxy]benzoyl]amino]methyl]furan-3-carboxylate
CID 55612622
3-[(3-carbamoylphenoxy)methyl]benzoic acid
CID 24710779
3-[[3-[(3-methylphenyl)methoxy]benzoyl]amino]benzoic acid
CID 164625380
methyl 6-[[3-[(3-methylphenyl)methoxy]benzoyl]amino]hexanoate
CID 46557017
N'-[3-[(3-methylphenyl)methoxy]benzoyl]pyridine-3-carbohydrazide
CID 35153545

Frequently Asked Questions

What is the IUPAC name of 3-[[[3-[(3-methylphenyl)methoxy]benzoyl]amino]methyl]benzamide?
The IUPAC name of 3-[[[3-[(3-methylphenyl)methoxy]benzoyl]amino]methyl]benzamide (CID 33097042) is 3-[[[3-[(3-methylphenyl)methoxy]benzoyl]amino]methyl]benzamide.
What is the SMILES notation for 3-[[[3-[(3-methylphenyl)methoxy]benzoyl]amino]methyl]benzamide?
The canonical SMILES for 3-[[[3-[(3-methylphenyl)methoxy]benzoyl]amino]methyl]benzamide is Cc1cccc(COc2cccc(C(=O)NCc3cccc(C(N)=O)c3)c2)c1.
What is the InChIKey of 3-[[[3-[(3-methylphenyl)methoxy]benzoyl]amino]methyl]benzamide?
The InChIKey is YXZKHOKCJFRGBQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H22N2O3/c1-16-5-2-7-18(11-16)15-28-21-10-4-9-20(13-21)23(27)25-14-17-6-3-8-19(12-17)22(24)26/h2-13H,14-15H2,1H3,(H2,24,26)(H,25,27).
What are the key properties of 3-[[[3-[(3-methylphenyl)methoxy]benzoyl]amino]methyl]benzamide?
3-[[[3-[(3-methylphenyl)methoxy]benzoyl]amino]methyl]benzamide has a molecular weight of 374.44 g/mol, XLogP of 3.60, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[[[3-[(3-methylphenyl)methoxy]benzoyl]amino]methyl]benzamide is sourced from PubChem (CID 33097042), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).