3-ethoxy-N-[2-[(3-ethoxybenzoyl)amino]phenyl]benzamide

C24H24N2O4 — CID 4958088

IUPAC3-ethoxy-N-[2-[(3-ethoxybenzoyl)amino]phenyl]benzamide
SMILESCCOc1cccc(C(=O)Nc2ccccc2NC(=O)c2cccc(OCC)c2)c1
InChIInChI=1S/C24H24N2O4/c1-3-29-19-11-7-9-17(15-19)23(27)25-21-13-5-6-14-22(21)26-24(28)18-10-8-12-20(16-18)30-4-2/h5-16H,3-4H2,1-2H3,(H,25,27)(H,26,28)
InChIKeyMLQDHMYVQLKSLC-UHFFFAOYSA-N
MW404.47 g/mol
LogP4.99
Rot. Bonds8

About 3-ethoxy-N-[2-[(3-ethoxybenzoyl)amino]phenyl]benzamide

3-ethoxy-N-[2-[(3-ethoxybenzoyl)amino]phenyl]benzamide (PubChem CID 4958088) has the molecular formula C24H24N2O4 and a molecular weight of 404.47 g/mol. Its IUPAC name is 3-ethoxy-N-[2-[(3-ethoxybenzoyl)amino]phenyl]benzamide.

Molecular Properties

Compound Name3-ethoxy-N-[2-[(3-ethoxybenzoyl)amino]phenyl]benzamide
PubChem CID4958088
Molecular FormulaC24H24N2O4
Molecular Weight404.47 g/mol
Exact Mass404.17
IUPAC Name3-ethoxy-N-[2-[(3-ethoxybenzoyl)amino]phenyl]benzamide
SMILESCCOc1cccc(C(=O)Nc2ccccc2NC(=O)c2cccc(OCC)c2)c1
InChIInChI=1S/C24H24N2O4/c1-3-29-19-11-7-9-17(15-19)23(27)25-21-13-5-6-14-22(21)26-24(28)18-10-8-12-20(16-18)30-4-2/h5-16H,3-4H2,1-2H3,(H,25,27)(H,26,28)
InChIKeyMLQDHMYVQLKSLC-UHFFFAOYSA-N
XLogP4.99
TPSA76.66 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500404.47
LogP ≤ 54.99
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

3-ethoxy-N-(2-propan-2-ylphenyl)benzamide
CID 799138
methyl 2-[(3-ethoxybenzoyl)amino]benzoate
CID 881681
N-[2-(difluoromethoxy)phenyl]-3-ethoxybenzamide
CID 934563
3-ethoxy-N-(2-phenylmethoxyphenyl)benzamide
CID 17093571
3-ethoxy-N-(2,4,5-trichlorophenyl)benzamide
CID 790473
2-[[3-[(3-ethoxybenzoyl)amino]benzoyl]amino]benzoic acid
CID 17297003
N-benzyl-2-[(3-ethoxybenzoyl)amino]benzamide
CID 4957453
3-ethoxy-N-(4-iodo-2-methylphenyl)benzamide
CID 23733721
N-(2-amino-4-methylphenyl)-3-ethoxybenzamide
CID 56773265
N-(4-amino-2-chlorophenyl)-3-ethoxybenzamide
CID 100829813
N-[2-[(2S)-butan-2-yl]phenyl]-3-(2-methylpropoxy)benzamide
CID 959928
3-ethoxy-N-[2-[(3-ethoxybenzoyl)amino]ethyl]benzamide
CID 4958095

Frequently Asked Questions

What is the IUPAC name of 3-ethoxy-N-[2-[(3-ethoxybenzoyl)amino]phenyl]benzamide?
The IUPAC name of 3-ethoxy-N-[2-[(3-ethoxybenzoyl)amino]phenyl]benzamide (CID 4958088) is 3-ethoxy-N-[2-[(3-ethoxybenzoyl)amino]phenyl]benzamide.
What is the SMILES notation for 3-ethoxy-N-[2-[(3-ethoxybenzoyl)amino]phenyl]benzamide?
The canonical SMILES for 3-ethoxy-N-[2-[(3-ethoxybenzoyl)amino]phenyl]benzamide is CCOc1cccc(C(=O)Nc2ccccc2NC(=O)c2cccc(OCC)c2)c1.
What is the InChIKey of 3-ethoxy-N-[2-[(3-ethoxybenzoyl)amino]phenyl]benzamide?
The InChIKey is MLQDHMYVQLKSLC-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H24N2O4/c1-3-29-19-11-7-9-17(15-19)23(27)25-21-13-5-6-14-22(21)26-24(28)18-10-8-12-20(16-18)30-4-2/h5-16H,3-4H2,1-2H3,(H,25,27)(H,26,28).
What are the key properties of 3-ethoxy-N-[2-[(3-ethoxybenzoyl)amino]phenyl]benzamide?
3-ethoxy-N-[2-[(3-ethoxybenzoyl)amino]phenyl]benzamide has a molecular weight of 404.47 g/mol, XLogP of 4.99, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethoxy-N-[2-[(3-ethoxybenzoyl)amino]phenyl]benzamide is sourced from PubChem (CID 4958088), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).