(2R)-2-(3-bromophenoxy)-N-(ethylcarbamoyl)-2-phenylacetamide

C17H17BrN2O3 — CID 7818419

IUPAC(2R)-2-(3-bromophenoxy)-N-(ethylcarbamoyl)-2-phenylacetamide
SMILESCCNC(=O)NC(=O)[C@H](Oc1cccc(Br)c1)c1ccccc1
InChIInChI=1S/C17H17BrN2O3/c1-2-19-17(22)20-16(21)15(12-7-4-3-5-8-12)23-14-10-6-9-13(18)11-14/h3-11,15H,2H2,1H3,(H2,19,20,21,22)/t15-/m1/s1
InChIKeyJAZYHWXEZVCWHP-OAHLLOKOSA-N
MW377.24 g/mol
LogP3.41
Rot. Bonds5

About (2R)-2-(3-bromophenoxy)-N-(ethylcarbamoyl)-2-phenylacetamide

(2R)-2-(3-bromophenoxy)-N-(ethylcarbamoyl)-2-phenylacetamide (PubChem CID 7818419) has the molecular formula C17H17BrN2O3 and a molecular weight of 377.24 g/mol. Its IUPAC name is (2R)-2-(3-bromophenoxy)-N-(ethylcarbamoyl)-2-phenylacetamide.

Molecular Properties

Compound Name(2R)-2-(3-bromophenoxy)-N-(ethylcarbamoyl)-2-phenylacetamide
PubChem CID7818419
Molecular FormulaC17H17BrN2O3
Molecular Weight377.24 g/mol
Exact Mass376.04
IUPAC Name(2R)-2-(3-bromophenoxy)-N-(ethylcarbamoyl)-2-phenylacetamide
SMILESCCNC(=O)NC(=O)[C@H](Oc1cccc(Br)c1)c1ccccc1
InChIInChI=1S/C17H17BrN2O3/c1-2-19-17(22)20-16(21)15(12-7-4-3-5-8-12)23-14-10-6-9-13(18)11-14/h3-11,15H,2H2,1H3,(H2,19,20,21,22)/t15-/m1/s1
InChIKeyJAZYHWXEZVCWHP-OAHLLOKOSA-N
XLogP3.41
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500377.24
LogP ≤ 53.41
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (2R)-2-(3-bromophenoxy)-N-(ethylcarbamoyl)-2-phenylacetamide?
The IUPAC name of (2R)-2-(3-bromophenoxy)-N-(ethylcarbamoyl)-2-phenylacetamide (CID 7818419) is (2R)-2-(3-bromophenoxy)-N-(ethylcarbamoyl)-2-phenylacetamide.
What is the SMILES notation for (2R)-2-(3-bromophenoxy)-N-(ethylcarbamoyl)-2-phenylacetamide?
The canonical SMILES for (2R)-2-(3-bromophenoxy)-N-(ethylcarbamoyl)-2-phenylacetamide is CCNC(=O)NC(=O)[C@H](Oc1cccc(Br)c1)c1ccccc1.
What is the InChIKey of (2R)-2-(3-bromophenoxy)-N-(ethylcarbamoyl)-2-phenylacetamide?
The InChIKey is JAZYHWXEZVCWHP-OAHLLOKOSA-N. The full InChI is InChI=1S/C17H17BrN2O3/c1-2-19-17(22)20-16(21)15(12-7-4-3-5-8-12)23-14-10-6-9-13(18)11-14/h3-11,15H,2H2,1H3,(H2,19,20,21,22)/t15-/m1/s1.
What are the key properties of (2R)-2-(3-bromophenoxy)-N-(ethylcarbamoyl)-2-phenylacetamide?
(2R)-2-(3-bromophenoxy)-N-(ethylcarbamoyl)-2-phenylacetamide has a molecular weight of 377.24 g/mol, XLogP of 3.41, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-(3-bromophenoxy)-N-(ethylcarbamoyl)-2-phenylacetamide is sourced from PubChem (CID 7818419), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).