N-[3-[[2-[benzyl(methyl)amino]-2-oxoethyl]amino]phenyl]benzamide

C23H23N3O2 — CID 54839121

IUPACN-[3-[[2-[benzyl(methyl)amino]-2-oxoethyl]amino]phenyl]benzamide
SMILESCN(Cc1ccccc1)C(=O)CNc1cccc(NC(=O)c2ccccc2)c1
InChIInChI=1S/C23H23N3O2/c1-26(17-18-9-4-2-5-10-18)22(27)16-24-20-13-8-14-21(15-20)25-23(28)19-11-6-3-7-12-19/h2-15,24H,16-17H2,1H3,(H,25,28)
InChIKeyCPAVERDAGIXFNG-UHFFFAOYSA-N
MW373.46 g/mol
LogP4.01
Rot. Bonds7

About N-[3-[[2-[benzyl(methyl)amino]-2-oxoethyl]amino]phenyl]benzamide

N-[3-[[2-[benzyl(methyl)amino]-2-oxoethyl]amino]phenyl]benzamide (PubChem CID 54839121) has the molecular formula C23H23N3O2 and a molecular weight of 373.46 g/mol. Its IUPAC name is N-[3-[[2-[benzyl(methyl)amino]-2-oxoethyl]amino]phenyl]benzamide.

Molecular Properties

Compound NameN-[3-[[2-[benzyl(methyl)amino]-2-oxoethyl]amino]phenyl]benzamide
PubChem CID54839121
Molecular FormulaC23H23N3O2
Molecular Weight373.46 g/mol
Exact Mass373.18
IUPAC NameN-[3-[[2-[benzyl(methyl)amino]-2-oxoethyl]amino]phenyl]benzamide
SMILESCN(Cc1ccccc1)C(=O)CNc1cccc(NC(=O)c2ccccc2)c1
InChIInChI=1S/C23H23N3O2/c1-26(17-18-9-4-2-5-10-18)22(27)16-24-20-13-8-14-21(15-20)25-23(28)19-11-6-3-7-12-19/h2-15,24H,16-17H2,1H3,(H,25,28)
InChIKeyCPAVERDAGIXFNG-UHFFFAOYSA-N
XLogP4.01
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms28
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500373.46
LogP ≤ 54.01
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[3-[[2-[benzyl(methyl)amino]-2-oxoethyl]amino]phenyl]benzamide?
The IUPAC name of N-[3-[[2-[benzyl(methyl)amino]-2-oxoethyl]amino]phenyl]benzamide (CID 54839121) is N-[3-[[2-[benzyl(methyl)amino]-2-oxoethyl]amino]phenyl]benzamide.
What is the SMILES notation for N-[3-[[2-[benzyl(methyl)amino]-2-oxoethyl]amino]phenyl]benzamide?
The canonical SMILES for N-[3-[[2-[benzyl(methyl)amino]-2-oxoethyl]amino]phenyl]benzamide is CN(Cc1ccccc1)C(=O)CNc1cccc(NC(=O)c2ccccc2)c1.
What is the InChIKey of N-[3-[[2-[benzyl(methyl)amino]-2-oxoethyl]amino]phenyl]benzamide?
The InChIKey is CPAVERDAGIXFNG-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H23N3O2/c1-26(17-18-9-4-2-5-10-18)22(27)16-24-20-13-8-14-21(15-20)25-23(28)19-11-6-3-7-12-19/h2-15,24H,16-17H2,1H3,(H,25,28).
What are the key properties of N-[3-[[2-[benzyl(methyl)amino]-2-oxoethyl]amino]phenyl]benzamide?
N-[3-[[2-[benzyl(methyl)amino]-2-oxoethyl]amino]phenyl]benzamide has a molecular weight of 373.46 g/mol, XLogP of 4.01, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-[[2-[benzyl(methyl)amino]-2-oxoethyl]amino]phenyl]benzamide is sourced from PubChem (CID 54839121), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).