N-[(E)-1,1-diphenylpropan-2-ylideneamino]-2-ethoxyacetamide

C19H22N2O2 — CID 54785224

IUPACN-[(E)-1,1-diphenylpropan-2-ylideneamino]-2-ethoxyacetamide
SMILESCCOCC(=O)N/N=C(\C)C(c1ccccc1)c1ccccc1
InChIInChI=1S/C19H22N2O2/c1-3-23-14-18(22)21-20-15(2)19(16-10-6-4-7-11-16)17-12-8-5-9-13-17/h4-13,19H,3,14H2,1-2H3,(H,21,22)/b20-15+
InChIKeyMTMFPENAHNBMJX-HMMYKYKNSA-N
MW310.40 g/mol
LogP3.35
Rot. Bonds7

About N-[(E)-1,1-diphenylpropan-2-ylideneamino]-2-ethoxyacetamide

N-[(E)-1,1-diphenylpropan-2-ylideneamino]-2-ethoxyacetamide (PubChem CID 54785224) has the molecular formula C19H22N2O2 and a molecular weight of 310.40 g/mol. Its IUPAC name is N-[(E)-1,1-diphenylpropan-2-ylideneamino]-2-ethoxyacetamide.

Molecular Properties

Compound NameN-[(E)-1,1-diphenylpropan-2-ylideneamino]-2-ethoxyacetamide
PubChem CID54785224
Molecular FormulaC19H22N2O2
Molecular Weight310.40 g/mol
Exact Mass310.17
IUPAC NameN-[(E)-1,1-diphenylpropan-2-ylideneamino]-2-ethoxyacetamide
SMILESCCOCC(=O)N/N=C(\C)C(c1ccccc1)c1ccccc1
InChIInChI=1S/C19H22N2O2/c1-3-23-14-18(22)21-20-15(2)19(16-10-6-4-7-11-16)17-12-8-5-9-13-17/h4-13,19H,3,14H2,1-2H3,(H,21,22)/b20-15+
InChIKeyMTMFPENAHNBMJX-HMMYKYKNSA-N
XLogP3.35
TPSA50.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.40
LogP ≤ 53.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

2-(2-chlorophenoxy)-N-[(E)-1,1-diphenylpropan-2-ylideneamino]acetamide
CID 54785318
2-(2-butan-2-ylphenoxy)-N-[(E)-1,1-diphenylpropan-2-ylideneamino]acetamide
CID 54785277
2-(2,4-dichlorophenoxy)-N-[(E)-1,1-diphenylpropan-2-ylideneamino]acetamide
CID 54785241
2-(1-bromonaphthalen-2-yl)oxy-N-[(E)-1,1-diphenylpropan-2-ylideneamino]acetamide
CID 54785322
N-[(E)-1,1-diphenylpropan-2-ylideneamino]benzamide
CID 54785289
2-(2-bromo-4-tert-butylphenoxy)-N-[(E)-1,1-diphenylpropan-2-ylideneamino]acetamide
CID 54785246
2-ethoxy-N-(2-hydroxy-1-phenylethyl)acetamide
CID 63184517
2-ethoxy-N-[(1S)-2-hydroxy-1-phenylethyl]acetamide
CID 103944946
2-ethoxy-N-(2-phenylpropyl)acetamide
CID 60637427
N-(2-amino-1-phenylethyl)-2-ethoxyacetamide
CID 63755765
N-[(E)-1,1-diphenylpropan-2-ylideneamino]-4-phenylbenzamide
CID 54785301
[(E)-1,1-diphenylpropan-2-ylideneamino]thiourea
CID 54785271

Frequently Asked Questions

What is the IUPAC name of N-[(E)-1,1-diphenylpropan-2-ylideneamino]-2-ethoxyacetamide?
The IUPAC name of N-[(E)-1,1-diphenylpropan-2-ylideneamino]-2-ethoxyacetamide (CID 54785224) is N-[(E)-1,1-diphenylpropan-2-ylideneamino]-2-ethoxyacetamide.
What is the SMILES notation for N-[(E)-1,1-diphenylpropan-2-ylideneamino]-2-ethoxyacetamide?
The canonical SMILES for N-[(E)-1,1-diphenylpropan-2-ylideneamino]-2-ethoxyacetamide is CCOCC(=O)N/N=C(\C)C(c1ccccc1)c1ccccc1.
What is the InChIKey of N-[(E)-1,1-diphenylpropan-2-ylideneamino]-2-ethoxyacetamide?
The InChIKey is MTMFPENAHNBMJX-HMMYKYKNSA-N. The full InChI is InChI=1S/C19H22N2O2/c1-3-23-14-18(22)21-20-15(2)19(16-10-6-4-7-11-16)17-12-8-5-9-13-17/h4-13,19H,3,14H2,1-2H3,(H,21,22)/b20-15+.
What are the key properties of N-[(E)-1,1-diphenylpropan-2-ylideneamino]-2-ethoxyacetamide?
N-[(E)-1,1-diphenylpropan-2-ylideneamino]-2-ethoxyacetamide has a molecular weight of 310.40 g/mol, XLogP of 3.35, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(E)-1,1-diphenylpropan-2-ylideneamino]-2-ethoxyacetamide is sourced from PubChem (CID 54785224), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).