N-(2-ethoxyphenyl)-2-[(2-methoxyphenyl)methyl-methylamino]-2-phenylacetamide

C25H28N2O3 — CID 55351620

IUPACN-(2-ethoxyphenyl)-2-[(2-methoxyphenyl)methyl-methylamino]-2-phenylacetamide
SMILESCCOc1ccccc1NC(=O)C(c1ccccc1)N(C)Cc1ccccc1OC
InChIInChI=1S/C25H28N2O3/c1-4-30-23-17-11-9-15-21(23)26-25(28)24(19-12-6-5-7-13-19)27(2)18-20-14-8-10-16-22(20)29-3/h5-17,24H,4,18H2,1-3H3,(H,26,28)
InChIKeyPKPPJNHNTSOKCL-UHFFFAOYSA-N
MW404.51 g/mol
LogP4.91
Rot. Bonds9

About N-(2-ethoxyphenyl)-2-[(2-methoxyphenyl)methyl-methylamino]-2-phenylacetamide

N-(2-ethoxyphenyl)-2-[(2-methoxyphenyl)methyl-methylamino]-2-phenylacetamide (PubChem CID 55351620) has the molecular formula C25H28N2O3 and a molecular weight of 404.51 g/mol. Its IUPAC name is N-(2-ethoxyphenyl)-2-[(2-methoxyphenyl)methyl-methylamino]-2-phenylacetamide.

Molecular Properties

Compound NameN-(2-ethoxyphenyl)-2-[(2-methoxyphenyl)methyl-methylamino]-2-phenylacetamide
PubChem CID55351620
Molecular FormulaC25H28N2O3
Molecular Weight404.51 g/mol
Exact Mass404.21
IUPAC NameN-(2-ethoxyphenyl)-2-[(2-methoxyphenyl)methyl-methylamino]-2-phenylacetamide
SMILESCCOc1ccccc1NC(=O)C(c1ccccc1)N(C)Cc1ccccc1OC
InChIInChI=1S/C25H28N2O3/c1-4-30-23-17-11-9-15-21(23)26-25(28)24(19-12-6-5-7-13-19)27(2)18-20-14-8-10-16-22(20)29-3/h5-17,24H,4,18H2,1-3H3,(H,26,28)
InChIKeyPKPPJNHNTSOKCL-UHFFFAOYSA-N
XLogP4.91
TPSA50.80 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500404.51
LogP ≤ 54.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-[[2-(2,6-dichloroanilino)-2-oxoethyl]-methylamino]-N-(2-ethoxyphenyl)-2-phenylacetamide
CID 55351296
(2S)-2-amino-N-(2-ethoxyphenyl)-2-phenylacetamide
CID 22691717
2-[(2,4-dimethoxyphenyl)methyl-methylamino]-N,2-diphenylacetamide
CID 55471442
(2S)-N-(2-methoxy-5-methylphenyl)-2-[methyl-[(2-methylphenyl)methyl]amino]-2-phenylacetamide
CID 8516586
(2R)-2-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl-methylamino]-N-(2-ethoxyphenyl)-2-phenylacetamide
CID 124738878
1-benzhydryl-3-(2-ethoxyphenyl)urea
CID 108867539
2-[(2,3-dimethoxyphenyl)methyl-methylamino]-N-(2,5-dimethylphenyl)-2-phenylacetamide
CID 4882071
(2R)-2-[(2,4-dimethoxyphenyl)methyl-methylamino]-N-(4-fluorophenyl)-2-phenylacetamide
CID 2689336
(2S)-N-(2-ethoxyphenyl)-2-[methyl-[(4-propan-2-ylphenyl)methyl]amino]propanamide
CID 40761080
(2R)-N-(ethylcarbamoyl)-2-[(2-methoxy-5-methylphenyl)methyl-methylamino]-2-phenylacetamide
CID 8805645
[(1S)-2-(2-ethoxyanilino)-2-oxo-1-phenylethyl]-propan-2-ylazanium
CID 2533842
(2S)-2-[(2-ethoxyphenyl)methyl-methylamino]propanoic acid
CID 92930759

Frequently Asked Questions

What is the IUPAC name of N-(2-ethoxyphenyl)-2-[(2-methoxyphenyl)methyl-methylamino]-2-phenylacetamide?
The IUPAC name of N-(2-ethoxyphenyl)-2-[(2-methoxyphenyl)methyl-methylamino]-2-phenylacetamide (CID 55351620) is N-(2-ethoxyphenyl)-2-[(2-methoxyphenyl)methyl-methylamino]-2-phenylacetamide.
What is the SMILES notation for N-(2-ethoxyphenyl)-2-[(2-methoxyphenyl)methyl-methylamino]-2-phenylacetamide?
The canonical SMILES for N-(2-ethoxyphenyl)-2-[(2-methoxyphenyl)methyl-methylamino]-2-phenylacetamide is CCOc1ccccc1NC(=O)C(c1ccccc1)N(C)Cc1ccccc1OC.
What is the InChIKey of N-(2-ethoxyphenyl)-2-[(2-methoxyphenyl)methyl-methylamino]-2-phenylacetamide?
The InChIKey is PKPPJNHNTSOKCL-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H28N2O3/c1-4-30-23-17-11-9-15-21(23)26-25(28)24(19-12-6-5-7-13-19)27(2)18-20-14-8-10-16-22(20)29-3/h5-17,24H,4,18H2,1-3H3,(H,26,28).
What are the key properties of N-(2-ethoxyphenyl)-2-[(2-methoxyphenyl)methyl-methylamino]-2-phenylacetamide?
N-(2-ethoxyphenyl)-2-[(2-methoxyphenyl)methyl-methylamino]-2-phenylacetamide has a molecular weight of 404.51 g/mol, XLogP of 4.91, 9 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-ethoxyphenyl)-2-[(2-methoxyphenyl)methyl-methylamino]-2-phenylacetamide is sourced from PubChem (CID 55351620), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).