2-[[2-(3-carbamoylphenoxy)acetyl]amino]-N-[(4-methylphenyl)methyl]benzamide

C24H23N3O4 — CID 55910870

IUPAC2-[[2-(3-carbamoylphenoxy)acetyl]amino]-N-[(4-methylphenyl)methyl]benzamide
SMILESCc1ccc(CNC(=O)c2ccccc2NC(=O)COc2cccc(C(N)=O)c2)cc1
InChIInChI=1S/C24H23N3O4/c1-16-9-11-17(12-10-16)14-26-24(30)20-7-2-3-8-21(20)27-22(28)15-31-19-6-4-5-18(13-19)23(25)29/h2-13H,14-15H2,1H3,(H2,25,29)(H,26,30)(H,27,28)
InChIKeyNKOCDLGSUYBWOG-UHFFFAOYSA-N
MW417.47 g/mol
LogP3.04
Rot. Bonds8

About 2-[[2-(3-carbamoylphenoxy)acetyl]amino]-N-[(4-methylphenyl)methyl]benzamide

2-[[2-(3-carbamoylphenoxy)acetyl]amino]-N-[(4-methylphenyl)methyl]benzamide (PubChem CID 55910870) has the molecular formula C24H23N3O4 and a molecular weight of 417.47 g/mol. Its IUPAC name is 2-[[2-(3-carbamoylphenoxy)acetyl]amino]-N-[(4-methylphenyl)methyl]benzamide.

Molecular Properties

Compound Name2-[[2-(3-carbamoylphenoxy)acetyl]amino]-N-[(4-methylphenyl)methyl]benzamide
PubChem CID55910870
Molecular FormulaC24H23N3O4
Molecular Weight417.47 g/mol
Exact Mass417.17
IUPAC Name2-[[2-(3-carbamoylphenoxy)acetyl]amino]-N-[(4-methylphenyl)methyl]benzamide
SMILESCc1ccc(CNC(=O)c2ccccc2NC(=O)COc2cccc(C(N)=O)c2)cc1
InChIInChI=1S/C24H23N3O4/c1-16-9-11-17(12-10-16)14-26-24(30)20-7-2-3-8-21(20)27-22(28)15-31-19-6-4-5-18(13-19)23(25)29/h2-13H,14-15H2,1H3,(H2,25,29)(H,26,30)(H,27,28)
InChIKeyNKOCDLGSUYBWOG-UHFFFAOYSA-N
XLogP3.04
TPSA110.52 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500417.47
LogP ≤ 53.04
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

2-[[2-(3-acetylphenoxy)acetyl]amino]-N-[(4-methylphenyl)methyl]benzamide
CID 52891404
2-[[2-(3-methoxyphenoxy)acetyl]amino]-N-[(4-methylphenyl)methyl]benzamide
CID 112787422
2-[[2-(4-methylphenoxy)acetyl]amino]-N-[(4-methylphenyl)methyl]benzamide
CID 52891720
2-[[2-(4-fluorophenoxy)acetyl]amino]-N-[(4-methylphenyl)methyl]benzamide
CID 55327835
N-benzyl-3-[2-(2,5-dimethylanilino)-2-oxoethoxy]benzamide
CID 9253155
[2-[2-[(4-methylphenyl)methylcarbamoyl]anilino]-2-oxoethyl] 3-(methylsulfonylmethyl)benzoate
CID 27749348
[2-[2-[(4-methylphenyl)methylcarbamoyl]anilino]-2-oxoethyl] 6-methylpyridine-3-carboxylate
CID 46511969
N-benzyl-2-[(3-ethoxybenzoyl)amino]benzamide
CID 4957453
2-[[2-(3-methylphenoxy)acetyl]amino]-N-propylbenzamide
CID 4945928
N-(furan-2-ylmethyl)-2-[[2-(3-methylphenoxy)acetyl]amino]benzamide
CID 4938454
2-[[2-(3,5-dimethylphenoxy)acetyl]amino]-N-(pyridin-3-ylmethyl)benzamide
CID 21173810
N-benzyl-2-[(3-propoxybenzoyl)amino]benzamide
CID 4960084

Frequently Asked Questions

What is the IUPAC name of 2-[[2-(3-carbamoylphenoxy)acetyl]amino]-N-[(4-methylphenyl)methyl]benzamide?
The IUPAC name of 2-[[2-(3-carbamoylphenoxy)acetyl]amino]-N-[(4-methylphenyl)methyl]benzamide (CID 55910870) is 2-[[2-(3-carbamoylphenoxy)acetyl]amino]-N-[(4-methylphenyl)methyl]benzamide.
What is the SMILES notation for 2-[[2-(3-carbamoylphenoxy)acetyl]amino]-N-[(4-methylphenyl)methyl]benzamide?
The canonical SMILES for 2-[[2-(3-carbamoylphenoxy)acetyl]amino]-N-[(4-methylphenyl)methyl]benzamide is Cc1ccc(CNC(=O)c2ccccc2NC(=O)COc2cccc(C(N)=O)c2)cc1.
What is the InChIKey of 2-[[2-(3-carbamoylphenoxy)acetyl]amino]-N-[(4-methylphenyl)methyl]benzamide?
The InChIKey is NKOCDLGSUYBWOG-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H23N3O4/c1-16-9-11-17(12-10-16)14-26-24(30)20-7-2-3-8-21(20)27-22(28)15-31-19-6-4-5-18(13-19)23(25)29/h2-13H,14-15H2,1H3,(H2,25,29)(H,26,30)(H,27,28).
What are the key properties of 2-[[2-(3-carbamoylphenoxy)acetyl]amino]-N-[(4-methylphenyl)methyl]benzamide?
2-[[2-(3-carbamoylphenoxy)acetyl]amino]-N-[(4-methylphenyl)methyl]benzamide has a molecular weight of 417.47 g/mol, XLogP of 3.04, 8 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[2-(3-carbamoylphenoxy)acetyl]amino]-N-[(4-methylphenyl)methyl]benzamide is sourced from PubChem (CID 55910870), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).