N-ethyl-3-[[[2-(2-formylphenoxy)acetyl]amino]methyl]benzamide

C19H20N2O4 — CID 60513737

IUPACN-ethyl-3-[[[2-(2-formylphenoxy)acetyl]amino]methyl]benzamide
SMILESCCNC(=O)c1cccc(CNC(=O)COc2ccccc2C=O)c1
InChIInChI=1S/C19H20N2O4/c1-2-20-19(24)15-8-5-6-14(10-15)11-21-18(23)13-25-17-9-4-3-7-16(17)12-22/h3-10,12H,2,11,13H2,1H3,(H,20,24)(H,21,23)
InChIKeyQMDBZBLTHIUEJQ-UHFFFAOYSA-N
MW340.38 g/mol
LogP1.94
Rot. Bonds8

About N-ethyl-3-[[[2-(2-formylphenoxy)acetyl]amino]methyl]benzamide

N-ethyl-3-[[[2-(2-formylphenoxy)acetyl]amino]methyl]benzamide (PubChem CID 60513737) has the molecular formula C19H20N2O4 and a molecular weight of 340.38 g/mol. Its IUPAC name is N-ethyl-3-[[[2-(2-formylphenoxy)acetyl]amino]methyl]benzamide.

Molecular Properties

Compound NameN-ethyl-3-[[[2-(2-formylphenoxy)acetyl]amino]methyl]benzamide
PubChem CID60513737
Molecular FormulaC19H20N2O4
Molecular Weight340.38 g/mol
Exact Mass340.14
IUPAC NameN-ethyl-3-[[[2-(2-formylphenoxy)acetyl]amino]methyl]benzamide
SMILESCCNC(=O)c1cccc(CNC(=O)COc2ccccc2C=O)c1
InChIInChI=1S/C19H20N2O4/c1-2-20-19(24)15-8-5-6-14(10-15)11-21-18(23)13-25-17-9-4-3-7-16(17)12-22/h3-10,12H,2,11,13H2,1H3,(H,20,24)(H,21,23)
InChIKeyQMDBZBLTHIUEJQ-UHFFFAOYSA-N
XLogP1.94
TPSA84.50 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.38
LogP ≤ 51.94
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}

Analyze N-ethyl-3-[[[2-(2-formylphenoxy)acetyl]amino]methyl]benzamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-benzyl-2-(2-formyl-4-methylphenoxy)acetamide
CID 63325172
2-(2-formyl-4-methoxyphenoxy)-N-[(3-methoxyphenyl)methyl]acetamide
CID 8633789
2-(2-formylphenoxy)-N-[[4-(phenoxymethyl)phenyl]methyl]acetamide
CID 60513930
3-[[[2-(2-fluorophenoxy)acetyl]amino]methyl]-N-(furan-2-ylmethyl)benzamide
CID 55847820
N-[4-[[[2-(2-formylphenoxy)acetyl]amino]methyl]phenyl]furan-2-carboxamide
CID 30332762
[2-[[2-(ethylamino)-2-oxoethyl]amino]-2-oxoethyl] 2-(2-formylphenoxy)acetate
CID 9197712
3-N-[[4-[[[3-(benzylcarbamoyl)benzoyl]amino]methyl]phenyl]methyl]-1-N-ethylbenzene-1,3-dicarboxamide
CID 176788614
N-ethyl-3-[[(4-formamidobenzoyl)amino]methyl]benzamide
CID 71871569
2-(2-formylphenoxy)-N-(thiophen-2-ylmethyl)acetamide
CID 7762764
3-[[[2-(3-ethylphenoxy)acetyl]amino]methyl]-N-methylbenzamide
CID 33203040
3-[[[2-(2,4-dimethylphenoxy)acetyl]amino]methyl]-N-phenylbenzamide
CID 46475227
3-[[(N-benzyl-N'-methylcarbamimidoyl)amino]methyl]-N-ethylbenzamide
CID 110953022

Frequently Asked Questions

What is the IUPAC name of N-ethyl-3-[[[2-(2-formylphenoxy)acetyl]amino]methyl]benzamide?
The IUPAC name of N-ethyl-3-[[[2-(2-formylphenoxy)acetyl]amino]methyl]benzamide (CID 60513737) is N-ethyl-3-[[[2-(2-formylphenoxy)acetyl]amino]methyl]benzamide.
What is the SMILES notation for N-ethyl-3-[[[2-(2-formylphenoxy)acetyl]amino]methyl]benzamide?
The canonical SMILES for N-ethyl-3-[[[2-(2-formylphenoxy)acetyl]amino]methyl]benzamide is CCNC(=O)c1cccc(CNC(=O)COc2ccccc2C=O)c1.
What is the InChIKey of N-ethyl-3-[[[2-(2-formylphenoxy)acetyl]amino]methyl]benzamide?
The InChIKey is QMDBZBLTHIUEJQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N2O4/c1-2-20-19(24)15-8-5-6-14(10-15)11-21-18(23)13-25-17-9-4-3-7-16(17)12-22/h3-10,12H,2,11,13H2,1H3,(H,20,24)(H,21,23).
What are the key properties of N-ethyl-3-[[[2-(2-formylphenoxy)acetyl]amino]methyl]benzamide?
N-ethyl-3-[[[2-(2-formylphenoxy)acetyl]amino]methyl]benzamide has a molecular weight of 340.38 g/mol, XLogP of 1.94, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-3-[[[2-(2-formylphenoxy)acetyl]amino]methyl]benzamide is sourced from PubChem (CID 60513737), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).