(2S)-N-(2-ethoxyphenyl)-2-naphthalen-1-yloxy-2-phenylacetamide

C26H23NO3 — CID 7506073

IUPAC(2S)-N-(2-ethoxyphenyl)-2-naphthalen-1-yloxy-2-phenylacetamide
SMILESCCOc1ccccc1NC(=O)[C@@H](Oc1cccc2ccccc12)c1ccccc1
InChIInChI=1S/C26H23NO3/c1-2-29-24-17-9-8-16-22(24)27-26(28)25(20-12-4-3-5-13-20)30-23-18-10-14-19-11-6-7-15-21(19)23/h3-18,25H,2H2,1H3,(H,27,28)/t25-/m0/s1
InChIKeyMLZCRZGUUIXTTE-VWLOTQADSA-N
MW397.47 g/mol
LogP6.00
Rot. Bonds7

About (2S)-N-(2-ethoxyphenyl)-2-naphthalen-1-yloxy-2-phenylacetamide

(2S)-N-(2-ethoxyphenyl)-2-naphthalen-1-yloxy-2-phenylacetamide (PubChem CID 7506073) has the molecular formula C26H23NO3 and a molecular weight of 397.47 g/mol. Its IUPAC name is (2S)-N-(2-ethoxyphenyl)-2-naphthalen-1-yloxy-2-phenylacetamide.

Molecular Properties

Compound Name(2S)-N-(2-ethoxyphenyl)-2-naphthalen-1-yloxy-2-phenylacetamide
PubChem CID7506073
Molecular FormulaC26H23NO3
Molecular Weight397.47 g/mol
Exact Mass397.17
IUPAC Name(2S)-N-(2-ethoxyphenyl)-2-naphthalen-1-yloxy-2-phenylacetamide
SMILESCCOc1ccccc1NC(=O)[C@@H](Oc1cccc2ccccc12)c1ccccc1
InChIInChI=1S/C26H23NO3/c1-2-29-24-17-9-8-16-22(24)27-26(28)25(20-12-4-3-5-13-20)30-23-18-10-14-19-11-6-7-15-21(19)23/h3-18,25H,2H2,1H3,(H,27,28)/t25-/m0/s1
InChIKeyMLZCRZGUUIXTTE-VWLOTQADSA-N
XLogP6.00
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms30
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500397.47
LogP ≤ 56.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-[(1S)-2-(2-ethoxyanilino)-2-oxo-1-phenylethoxy]benzamide
CID 8607962
(2R)-2-(2-ethoxy-4-formylphenoxy)-N-(2-ethoxyphenyl)-2-phenylacetamide
CID 9201107
(2R)-2-(4-cyanophenoxy)-N-(2-ethoxyphenyl)-2-phenylacetamide
CID 7505945
(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] 3-hydroxynaphthalene-2-carboxylate
CID 2390960
[(1S)-2-(2-ethoxyanilino)-2-oxo-1-phenylethyl] 4-methoxybenzoate
CID 7506876
[(1R)-2-(2-ethoxyanilino)-2-oxo-1-phenylethyl] 2-methylquinoline-4-carboxylate
CID 41136561
1-benzhydryl-3-(2-ethoxyphenyl)urea
CID 108867539
N-(2-ethoxyphenyl)-2-[(2-naphthalen-1-ylacetyl)amino]propanamide
CID 17476443
[2-(2-ethoxyanilino)-2-oxo-1-phenylethyl] 2-ethoxypyridine-3-carboxylate
CID 4004793
[(1S)-2-(2-ethoxyanilino)-2-oxo-1-phenylethyl]-propan-2-ylazanium
CID 2533842

Frequently Asked Questions

What is the IUPAC name of (2S)-N-(2-ethoxyphenyl)-2-naphthalen-1-yloxy-2-phenylacetamide?
The IUPAC name of (2S)-N-(2-ethoxyphenyl)-2-naphthalen-1-yloxy-2-phenylacetamide (CID 7506073) is (2S)-N-(2-ethoxyphenyl)-2-naphthalen-1-yloxy-2-phenylacetamide.
What is the SMILES notation for (2S)-N-(2-ethoxyphenyl)-2-naphthalen-1-yloxy-2-phenylacetamide?
The canonical SMILES for (2S)-N-(2-ethoxyphenyl)-2-naphthalen-1-yloxy-2-phenylacetamide is CCOc1ccccc1NC(=O)[C@@H](Oc1cccc2ccccc12)c1ccccc1.
What is the InChIKey of (2S)-N-(2-ethoxyphenyl)-2-naphthalen-1-yloxy-2-phenylacetamide?
The InChIKey is MLZCRZGUUIXTTE-VWLOTQADSA-N. The full InChI is InChI=1S/C26H23NO3/c1-2-29-24-17-9-8-16-22(24)27-26(28)25(20-12-4-3-5-13-20)30-23-18-10-14-19-11-6-7-15-21(19)23/h3-18,25H,2H2,1H3,(H,27,28)/t25-/m0/s1.
What are the key properties of (2S)-N-(2-ethoxyphenyl)-2-naphthalen-1-yloxy-2-phenylacetamide?
(2S)-N-(2-ethoxyphenyl)-2-naphthalen-1-yloxy-2-phenylacetamide has a molecular weight of 397.47 g/mol, XLogP of 6.00, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-N-(2-ethoxyphenyl)-2-naphthalen-1-yloxy-2-phenylacetamide is sourced from PubChem (CID 7506073), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).