[(1R)-2-(2-ethoxyanilino)-2-oxo-1-phenylethyl]-[(4-methylphenyl)methyl]azanium

C24H27N2O2+ — CID 7928835

IUPAC[(1R)-2-(2-ethoxyanilino)-2-oxo-1-phenylethyl]-[(4-methylphenyl)methyl]azanium
SMILESCCOc1ccccc1NC(=O)[C@H]([NH2+]Cc1ccc(C)cc1)c1ccccc1
InChIInChI=1S/C24H26N2O2/c1-3-28-22-12-8-7-11-21(22)26-24(27)23(20-9-5-4-6-10-20)25-17-19-15-13-18(2)14-16-19/h4-16,23,25H,3,17H2,1-2H3,(H,26,27)/p+1/t23-/m1/s1
InChIKeyJEPQEJHOIXNOIV-HSZRJFAPSA-O
MW375.49 g/mol
LogP3.84
Rot. Bonds8

About [(1R)-2-(2-ethoxyanilino)-2-oxo-1-phenylethyl]-[(4-methylphenyl)methyl]azanium

[(1R)-2-(2-ethoxyanilino)-2-oxo-1-phenylethyl]-[(4-methylphenyl)methyl]azanium (PubChem CID 7928835) has the molecular formula C24H27N2O2+ and a molecular weight of 375.49 g/mol. Its IUPAC name is [(1R)-2-(2-ethoxyanilino)-2-oxo-1-phenylethyl]-[(4-methylphenyl)methyl]azanium.

Molecular Properties

Compound Name[(1R)-2-(2-ethoxyanilino)-2-oxo-1-phenylethyl]-[(4-methylphenyl)methyl]azanium
PubChem CID7928835
Molecular FormulaC24H27N2O2+
Molecular Weight375.49 g/mol
Exact Mass375.21
IUPAC Name[(1R)-2-(2-ethoxyanilino)-2-oxo-1-phenylethyl]-[(4-methylphenyl)methyl]azanium
SMILESCCOc1ccccc1NC(=O)[C@H]([NH2+]Cc1ccc(C)cc1)c1ccccc1
InChIInChI=1S/C24H26N2O2/c1-3-28-22-12-8-7-11-21(22)26-24(27)23(20-9-5-4-6-10-20)25-17-19-15-13-18(2)14-16-19/h4-16,23,25H,3,17H2,1-2H3,(H,26,27)/p+1/t23-/m1/s1
InChIKeyJEPQEJHOIXNOIV-HSZRJFAPSA-O
XLogP3.84
TPSA54.94 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500375.49
LogP ≤ 53.84
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze [(1R)-2-(2-ethoxyanilino)-2-oxo-1-phenylethyl]-[(4-methylphenyl)methyl]azanium with MolForge

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Related Compounds

[(1S)-2-(2-ethoxyanilino)-2-oxo-1-phenylethyl]-propan-2-ylazanium
CID 2533842
[(1S)-2-(2-ethoxyanilino)-2-oxo-1-phenylethyl]-(3-ethoxypropyl)azanium
CID 7928757
cycloheptyl-[(1S)-2-(2-ethoxyanilino)-2-oxo-1-phenylethyl]azanium
CID 8967736
(2S)-2-amino-N-(2-ethoxyphenyl)-2-phenylacetamide
CID 22691717
[(1S)-2-(2-ethoxyanilino)-2-oxo-1-phenylethyl] 4-(hydroxymethyl)benzoate
CID 2537822
[(1R)-2-(2-ethoxyanilino)-2-oxo-1-phenylethyl]-[(1S)-1,2,3,4-tetrahydronaphthalen-1-yl]azanium
CID 2468749
(2R)-N-(2-ethoxyphenyl)-2-(4-methylphenyl)sulfanylpropanamide
CID 42583664
1-benzhydryl-3-(2-ethoxyphenyl)urea
CID 108867539
[(1R)-2-(2-ethoxyanilino)-2-oxo-1-phenylethyl] 2-(4-chlorophenyl)acetate
CID 2092525
[(4S)-3,4-dihydro-2H-chromen-4-yl]-[(1S)-2-(2-ethoxyanilino)-2-oxo-1-phenylethyl]azanium
CID 8773859
[(1R)-2-(2-ethoxyanilino)-2-oxo-1-phenylethyl] 4-(methoxymethyl)benzoate
CID 7587707
[2-(2-ethoxyanilino)-2-oxoethyl]-[(1R)-1-phenylethyl]azanium
CID 8898297

Frequently Asked Questions

What is the IUPAC name of [(1R)-2-(2-ethoxyanilino)-2-oxo-1-phenylethyl]-[(4-methylphenyl)methyl]azanium?
The IUPAC name of [(1R)-2-(2-ethoxyanilino)-2-oxo-1-phenylethyl]-[(4-methylphenyl)methyl]azanium (CID 7928835) is [(1R)-2-(2-ethoxyanilino)-2-oxo-1-phenylethyl]-[(4-methylphenyl)methyl]azanium.
What is the SMILES notation for [(1R)-2-(2-ethoxyanilino)-2-oxo-1-phenylethyl]-[(4-methylphenyl)methyl]azanium?
The canonical SMILES for [(1R)-2-(2-ethoxyanilino)-2-oxo-1-phenylethyl]-[(4-methylphenyl)methyl]azanium is CCOc1ccccc1NC(=O)[C@H]([NH2+]Cc1ccc(C)cc1)c1ccccc1.
What is the InChIKey of [(1R)-2-(2-ethoxyanilino)-2-oxo-1-phenylethyl]-[(4-methylphenyl)methyl]azanium?
The InChIKey is JEPQEJHOIXNOIV-HSZRJFAPSA-O. The full InChI is InChI=1S/C24H26N2O2/c1-3-28-22-12-8-7-11-21(22)26-24(27)23(20-9-5-4-6-10-20)25-17-19-15-13-18(2)14-16-19/h4-16,23,25H,3,17H2,1-2H3,(H,26,27)/p+1/t23-/m1/s1.
What are the key properties of [(1R)-2-(2-ethoxyanilino)-2-oxo-1-phenylethyl]-[(4-methylphenyl)methyl]azanium?
[(1R)-2-(2-ethoxyanilino)-2-oxo-1-phenylethyl]-[(4-methylphenyl)methyl]azanium has a molecular weight of 375.49 g/mol, XLogP of 3.84, 8 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [(1R)-2-(2-ethoxyanilino)-2-oxo-1-phenylethyl]-[(4-methylphenyl)methyl]azanium is sourced from PubChem (CID 7928835), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).