N-[2-(5-benzamido-2-methylanilino)-2-oxoethyl]benzamide

C23H21N3O3 — CID 60518009

IUPACN-[2-(5-benzamido-2-methylanilino)-2-oxoethyl]benzamide
SMILESCc1ccc(NC(=O)c2ccccc2)cc1NC(=O)CNC(=O)c1ccccc1
InChIInChI=1S/C23H21N3O3/c1-16-12-13-19(25-23(29)18-10-6-3-7-11-18)14-20(16)26-21(27)15-24-22(28)17-8-4-2-5-9-17/h2-14H,15H2,1H3,(H,24,28)(H,25,29)(H,26,27)
InChIKeyGDSOILVUYSQTQU-UHFFFAOYSA-N
MW387.44 g/mol
LogP3.62
Rot. Bonds6

About N-[2-(5-benzamido-2-methylanilino)-2-oxoethyl]benzamide

N-[2-(5-benzamido-2-methylanilino)-2-oxoethyl]benzamide (PubChem CID 60518009) has the molecular formula C23H21N3O3 and a molecular weight of 387.44 g/mol. Its IUPAC name is N-[2-(5-benzamido-2-methylanilino)-2-oxoethyl]benzamide.

Molecular Properties

Compound NameN-[2-(5-benzamido-2-methylanilino)-2-oxoethyl]benzamide
PubChem CID60518009
Molecular FormulaC23H21N3O3
Molecular Weight387.44 g/mol
Exact Mass387.16
IUPAC NameN-[2-(5-benzamido-2-methylanilino)-2-oxoethyl]benzamide
SMILESCc1ccc(NC(=O)c2ccccc2)cc1NC(=O)CNC(=O)c1ccccc1
InChIInChI=1S/C23H21N3O3/c1-16-12-13-19(25-23(29)18-10-6-3-7-11-18)14-20(16)26-21(27)15-24-22(28)17-8-4-2-5-9-17/h2-14H,15H2,1H3,(H,24,28)(H,25,29)(H,26,27)
InChIKeyGDSOILVUYSQTQU-UHFFFAOYSA-N
XLogP3.62
TPSA87.30 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500387.44
LogP ≤ 53.62
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

N-[3-[[2-(ethylamino)-2-oxoethyl]carbamoylamino]-4-methylphenyl]benzamide
CID 86994865
N-[2-(5-fluoro-2-methylanilino)-2-oxoethyl]benzamide
CID 9211846
N-[3-(4-aminobutanoylamino)-4-methylphenyl]benzamide
CID 39193375
N-[3-[[2-[4-methyl-3-(propanoylamino)anilino]acetyl]amino]phenyl]benzamide
CID 54844860
N-(5-benzamido-2-methylphenyl)-4-(chloromethyl)benzamide
CID 22291056
N-[2-(5-acetamido-2-methylanilino)-2-oxoethyl]-4-ethoxybenzamide
CID 46463640
N-[4-methyl-3-[[7-(5-methylthiophen-2-yl)-4,7-dioxoheptanoyl]amino]phenyl]benzamide
CID 60517612
N-(3-benzamido-4-methylphenyl)pyridine-3-carboxamide
CID 6486649
3-benzamido-4-methyl-N-[4-(propanoylamino)phenyl]benzamide
CID 55788298
N-[2-(3-methylanilino)-2-oxoethyl]benzamide
CID 2968363
N-[3-[[2-(diethylamino)-2-oxoethyl]amino]-4-methylphenyl]benzamide
CID 47064079
N-[2-[4-methoxy-3-[(2-methoxyacetyl)amino]anilino]-2-oxoethyl]benzamide
CID 131925236

Frequently Asked Questions

What is the IUPAC name of N-[2-(5-benzamido-2-methylanilino)-2-oxoethyl]benzamide?
The IUPAC name of N-[2-(5-benzamido-2-methylanilino)-2-oxoethyl]benzamide (CID 60518009) is N-[2-(5-benzamido-2-methylanilino)-2-oxoethyl]benzamide.
What is the SMILES notation for N-[2-(5-benzamido-2-methylanilino)-2-oxoethyl]benzamide?
The canonical SMILES for N-[2-(5-benzamido-2-methylanilino)-2-oxoethyl]benzamide is Cc1ccc(NC(=O)c2ccccc2)cc1NC(=O)CNC(=O)c1ccccc1.
What is the InChIKey of N-[2-(5-benzamido-2-methylanilino)-2-oxoethyl]benzamide?
The InChIKey is GDSOILVUYSQTQU-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H21N3O3/c1-16-12-13-19(25-23(29)18-10-6-3-7-11-18)14-20(16)26-21(27)15-24-22(28)17-8-4-2-5-9-17/h2-14H,15H2,1H3,(H,24,28)(H,25,29)(H,26,27).
What are the key properties of N-[2-(5-benzamido-2-methylanilino)-2-oxoethyl]benzamide?
N-[2-(5-benzamido-2-methylanilino)-2-oxoethyl]benzamide has a molecular weight of 387.44 g/mol, XLogP of 3.62, 6 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(5-benzamido-2-methylanilino)-2-oxoethyl]benzamide is sourced from PubChem (CID 60518009), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).