N-(2-benzamido-1,2-diethoxyethyl)benzamide

C20H24N2O4 — CID 2829212

IUPACN-(2-benzamido-1,2-diethoxyethyl)benzamide
SMILESCCOC(NC(=O)c1ccccc1)C(NC(=O)c1ccccc1)OCC
InChIInChI=1S/C20H24N2O4/c1-3-25-19(21-17(23)15-11-7-5-8-12-15)20(26-4-2)22-18(24)16-13-9-6-10-14-16/h5-14,19-20H,3-4H2,1-2H3,(H,21,23)(H,22,24)
InChIKeySSESRMHURAXLED-UHFFFAOYSA-N
MW356.42 g/mol
LogP2.57
Rot. Bonds9

About N-(2-benzamido-1,2-diethoxyethyl)benzamide

N-(2-benzamido-1,2-diethoxyethyl)benzamide (PubChem CID 2829212) has the molecular formula C20H24N2O4 and a molecular weight of 356.42 g/mol. Its IUPAC name is N-(2-benzamido-1,2-diethoxyethyl)benzamide.

Molecular Properties

Compound NameN-(2-benzamido-1,2-diethoxyethyl)benzamide
PubChem CID2829212
Molecular FormulaC20H24N2O4
Molecular Weight356.42 g/mol
Exact Mass356.17
IUPAC NameN-(2-benzamido-1,2-diethoxyethyl)benzamide
SMILESCCOC(NC(=O)c1ccccc1)C(NC(=O)c1ccccc1)OCC
InChIInChI=1S/C20H24N2O4/c1-3-25-19(21-17(23)15-11-7-5-8-12-15)20(26-4-2)22-18(24)16-13-9-6-10-14-16/h5-14,19-20H,3-4H2,1-2H3,(H,21,23)(H,22,24)
InChIKeySSESRMHURAXLED-UHFFFAOYSA-N
XLogP2.57
TPSA76.66 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500356.42
LogP ≤ 52.57
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Related Compounds

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Npc171139
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ChiRYun
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Benzamide, 4-fluoro-N-(2-(4-morpholinyl)ethyl)-
CID 835134
Aurantiamide Acetate
CID 10026486
N-[3-(benzoylamino)propyl]benzamide
CID 255782
N-[(2S)-3-methyl-1-oxo-1-(2-phenylethylamino)butan-2-yl]benzamide
CID 2211217
N,N'-1,2-Ethanediylbisbenzamide
CID 69518
Benzamide, N,N'-1,6-hexanediylbis-
CID 219241
N-(2-morpholin-4-yl-2-oxoethyl)benzamide
CID 570439
N-[1-(2-Morpholin-4-yl-ethylcarbamoyl)-2-phenyl-vinyl]-benzamide
CID 2873163
N-[1-(benzylamino)-3-methyl-1-oxobut-2-en-2-yl]benzamide
CID 739165

Frequently Asked Questions

What is the IUPAC name of N-(2-benzamido-1,2-diethoxyethyl)benzamide?
The IUPAC name of N-(2-benzamido-1,2-diethoxyethyl)benzamide (CID 2829212) is N-(2-benzamido-1,2-diethoxyethyl)benzamide.
What is the SMILES notation for N-(2-benzamido-1,2-diethoxyethyl)benzamide?
The canonical SMILES for N-(2-benzamido-1,2-diethoxyethyl)benzamide is CCOC(NC(=O)c1ccccc1)C(NC(=O)c1ccccc1)OCC.
What is the InChIKey of N-(2-benzamido-1,2-diethoxyethyl)benzamide?
The InChIKey is SSESRMHURAXLED-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24N2O4/c1-3-25-19(21-17(23)15-11-7-5-8-12-15)20(26-4-2)22-18(24)16-13-9-6-10-14-16/h5-14,19-20H,3-4H2,1-2H3,(H,21,23)(H,22,24).
What are the key properties of N-(2-benzamido-1,2-diethoxyethyl)benzamide?
N-(2-benzamido-1,2-diethoxyethyl)benzamide has a molecular weight of 356.42 g/mol, XLogP of 2.57, 9 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-benzamido-1,2-diethoxyethyl)benzamide is sourced from PubChem (CID 2829212), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).