N-benzyl-2-[[2-[(2-oxo-3,4-dihydro-1H-quinolin-6-yl)oxy]acetyl]amino]benzamide

C25H23N3O4 — CID 24676625

IUPACN-benzyl-2-[[2-[(2-oxo-3,4-dihydro-1H-quinolin-6-yl)oxy]acetyl]amino]benzamide
SMILESO=C1CCc2cc(OCC(=O)Nc3ccccc3C(=O)NCc3ccccc3)ccc2N1
InChIInChI=1S/C25H23N3O4/c29-23-13-10-18-14-19(11-12-21(18)27-23)32-16-24(30)28-22-9-5-4-8-20(22)25(31)26-15-17-6-2-1-3-7-17/h1-9,11-12,14H,10,13,15-16H2,(H,26,31)(H,27,29)(H,28,30)
InChIKeySELUHQCCAILDCT-UHFFFAOYSA-N
MW429.48 g/mol
LogP3.52
Rot. Bonds7

About N-benzyl-2-[[2-[(2-oxo-3,4-dihydro-1H-quinolin-6-yl)oxy]acetyl]amino]benzamide

N-benzyl-2-[[2-[(2-oxo-3,4-dihydro-1H-quinolin-6-yl)oxy]acetyl]amino]benzamide (PubChem CID 24676625) has the molecular formula C25H23N3O4 and a molecular weight of 429.48 g/mol. Its IUPAC name is N-benzyl-2-[[2-[(2-oxo-3,4-dihydro-1H-quinolin-6-yl)oxy]acetyl]amino]benzamide.

Molecular Properties

Compound NameN-benzyl-2-[[2-[(2-oxo-3,4-dihydro-1H-quinolin-6-yl)oxy]acetyl]amino]benzamide
PubChem CID24676625
Molecular FormulaC25H23N3O4
Molecular Weight429.48 g/mol
Exact Mass429.17
IUPAC NameN-benzyl-2-[[2-[(2-oxo-3,4-dihydro-1H-quinolin-6-yl)oxy]acetyl]amino]benzamide
SMILESO=C1CCc2cc(OCC(=O)Nc3ccccc3C(=O)NCc3ccccc3)ccc2N1
InChIInChI=1S/C25H23N3O4/c29-23-13-10-18-14-19(11-12-21(18)27-23)32-16-24(30)28-22-9-5-4-8-20(22)25(31)26-15-17-6-2-1-3-7-17/h1-9,11-12,14H,10,13,15-16H2,(H,26,31)(H,27,29)(H,28,30)
InChIKeySELUHQCCAILDCT-UHFFFAOYSA-N
XLogP3.52
TPSA96.53 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500429.48
LogP ≤ 53.52
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Analyze N-benzyl-2-[[2-[(2-oxo-3,4-dihydro-1H-quinolin-6-yl)oxy]acetyl]amino]benzamide with MolForge

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Related Compounds

N-methyl-2-[[2-[(2-oxo-3,4-dihydro-1H-quinolin-6-yl)oxy]acetyl]amino]benzamide
CID 24670388
2-[[2-[(2-oxo-3,4-dihydro-1H-quinolin-6-yl)oxy]acetyl]amino]-N-propan-2-ylbenzamide
CID 55672954
N-naphthalen-2-yl-2-[(2-oxo-3,4-dihydro-1H-quinolin-6-yl)oxy]acetamide
CID 36507480
N-(2-cyclopentylsulfanylphenyl)-2-[(2-oxo-3,4-dihydro-1H-quinolin-6-yl)oxy]acetamide
CID 32560697
N-(2-oxo-3,4-dihydro-1H-quinolin-6-yl)-2-phenoxyacetamide
CID 18571268
2-[[2-(4-methylphenoxy)acetyl]amino]-N-[(4-methylphenyl)methyl]benzamide
CID 52891720
[2-[2-(2-methylpropylcarbamoyl)anilino]-2-oxoethyl] 2-oxo-3,4-dihydro-1H-quinoline-6-carboxylate
CID 46646037
N-[4-(2-methoxyethoxy)phenyl]-2-[(2-oxo-3,4-dihydro-1H-quinolin-6-yl)oxy]acetamide
CID 55658148
N-[(6-methoxynaphthalen-2-yl)methyl]-2-[(2-oxo-3,4-dihydro-1H-quinolin-6-yl)oxy]acetamide
CID 134050875
N-dibenzofuran-2-yl-2-[(2-oxo-3,4-dihydro-1H-quinolin-6-yl)oxy]acetamide
CID 24652342
2-[(2-oxo-3,4-dihydro-1H-quinolin-6-yl)oxy]-N-[[4-(propan-2-ylsulfamoylmethyl)phenyl]methyl]acetamide
CID 24652368
4-[(2-oxo-3,4-dihydro-1H-quinolin-6-yl)oxy]-N-[(3-phenoxyphenyl)methyl]butanamide
CID 55688683

Frequently Asked Questions

What is the IUPAC name of N-benzyl-2-[[2-[(2-oxo-3,4-dihydro-1H-quinolin-6-yl)oxy]acetyl]amino]benzamide?
The IUPAC name of N-benzyl-2-[[2-[(2-oxo-3,4-dihydro-1H-quinolin-6-yl)oxy]acetyl]amino]benzamide (CID 24676625) is N-benzyl-2-[[2-[(2-oxo-3,4-dihydro-1H-quinolin-6-yl)oxy]acetyl]amino]benzamide.
What is the SMILES notation for N-benzyl-2-[[2-[(2-oxo-3,4-dihydro-1H-quinolin-6-yl)oxy]acetyl]amino]benzamide?
The canonical SMILES for N-benzyl-2-[[2-[(2-oxo-3,4-dihydro-1H-quinolin-6-yl)oxy]acetyl]amino]benzamide is O=C1CCc2cc(OCC(=O)Nc3ccccc3C(=O)NCc3ccccc3)ccc2N1.
What is the InChIKey of N-benzyl-2-[[2-[(2-oxo-3,4-dihydro-1H-quinolin-6-yl)oxy]acetyl]amino]benzamide?
The InChIKey is SELUHQCCAILDCT-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H23N3O4/c29-23-13-10-18-14-19(11-12-21(18)27-23)32-16-24(30)28-22-9-5-4-8-20(22)25(31)26-15-17-6-2-1-3-7-17/h1-9,11-12,14H,10,13,15-16H2,(H,26,31)(H,27,29)(H,28,30).
What are the key properties of N-benzyl-2-[[2-[(2-oxo-3,4-dihydro-1H-quinolin-6-yl)oxy]acetyl]amino]benzamide?
N-benzyl-2-[[2-[(2-oxo-3,4-dihydro-1H-quinolin-6-yl)oxy]acetyl]amino]benzamide has a molecular weight of 429.48 g/mol, XLogP of 3.52, 7 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-2-[[2-[(2-oxo-3,4-dihydro-1H-quinolin-6-yl)oxy]acetyl]amino]benzamide is sourced from PubChem (CID 24676625), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).