2-(2-bromo-4-ethylphenoxy)-N-(2-phenylpropyl)acetamide

C19H22BrNO2 — CID 133164493

IUPAC2-(2-bromo-4-ethylphenoxy)-N-(2-phenylpropyl)acetamide
SMILESCCc1ccc(OCC(=O)NCC(C)c2ccccc2)c(Br)c1
InChIInChI=1S/C19H22BrNO2/c1-3-15-9-10-18(17(20)11-15)23-13-19(22)21-12-14(2)16-7-5-4-6-8-16/h4-11,14H,3,12-13H2,1-2H3,(H,21,22)
InChIKeyFCTFDXQTOQPPEA-UHFFFAOYSA-N
MW376.29 g/mol
LogP4.31
Rot. Bonds7

About 2-(2-bromo-4-ethylphenoxy)-N-(2-phenylpropyl)acetamide

2-(2-bromo-4-ethylphenoxy)-N-(2-phenylpropyl)acetamide (PubChem CID 133164493) has the molecular formula C19H22BrNO2 and a molecular weight of 376.29 g/mol. Its IUPAC name is 2-(2-bromo-4-ethylphenoxy)-N-(2-phenylpropyl)acetamide.

Molecular Properties

Compound Name2-(2-bromo-4-ethylphenoxy)-N-(2-phenylpropyl)acetamide
PubChem CID133164493
Molecular FormulaC19H22BrNO2
Molecular Weight376.29 g/mol
Exact Mass375.08
IUPAC Name2-(2-bromo-4-ethylphenoxy)-N-(2-phenylpropyl)acetamide
SMILESCCc1ccc(OCC(=O)NCC(C)c2ccccc2)c(Br)c1
InChIInChI=1S/C19H22BrNO2/c1-3-15-9-10-18(17(20)11-15)23-13-19(22)21-12-14(2)16-7-5-4-6-8-16/h4-11,14H,3,12-13H2,1-2H3,(H,21,22)
InChIKeyFCTFDXQTOQPPEA-UHFFFAOYSA-N
XLogP4.31
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500376.29
LogP ≤ 54.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(2-bromo-4-ethylphenoxy)-N-(1-phenylethyl)acetamide
CID 2942651
2-(4-bromo-2-chlorophenoxy)-N-[(2S)-2-phenylpropyl]acetamide
CID 7809627
2-(2-bromo-4-ethylphenoxy)acetohydrazide
CID 965908
2-(2-bromo-4-ethylphenoxy)-N-[(4-methylphenyl)methyl]acetamide
CID 988892
2-[4-(aminomethyl)-2-bromophenoxy]-N-(2-methylpropyl)acetamide
CID 55147518
2-(4-bromo-5-formyl-2-methoxyphenoxy)-N-[(2S)-2-phenylpropyl]acetamide
CID 7568704
2-(2-bromo-4-propylphenoxy)-N-(2-phenylethyl)acetamide
CID 19201978
[2-oxo-2-[[(2R)-2-phenylpropyl]amino]ethyl] 5-bromofuran-2-carboxylate
CID 7716846
2-(2-bromo-4-ethylphenoxy)-N-tert-butylacetamide
CID 833491
N-[3-[[2-(2-bromo-4-ethylphenoxy)acetyl]amino]phenyl]-2-phenoxyacetamide
CID 17231336
2-(2-acetyl-4-chlorophenoxy)-N-[(2S)-2-phenylpropyl]acetamide
CID 7167691
N'-[2-(2-bromo-4-ethylphenoxy)acetyl]-2-propan-2-yloxybenzohydrazide
CID 17045696

Frequently Asked Questions

What is the IUPAC name of 2-(2-bromo-4-ethylphenoxy)-N-(2-phenylpropyl)acetamide?
The IUPAC name of 2-(2-bromo-4-ethylphenoxy)-N-(2-phenylpropyl)acetamide (CID 133164493) is 2-(2-bromo-4-ethylphenoxy)-N-(2-phenylpropyl)acetamide.
What is the SMILES notation for 2-(2-bromo-4-ethylphenoxy)-N-(2-phenylpropyl)acetamide?
The canonical SMILES for 2-(2-bromo-4-ethylphenoxy)-N-(2-phenylpropyl)acetamide is CCc1ccc(OCC(=O)NCC(C)c2ccccc2)c(Br)c1.
What is the InChIKey of 2-(2-bromo-4-ethylphenoxy)-N-(2-phenylpropyl)acetamide?
The InChIKey is FCTFDXQTOQPPEA-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22BrNO2/c1-3-15-9-10-18(17(20)11-15)23-13-19(22)21-12-14(2)16-7-5-4-6-8-16/h4-11,14H,3,12-13H2,1-2H3,(H,21,22).
What are the key properties of 2-(2-bromo-4-ethylphenoxy)-N-(2-phenylpropyl)acetamide?
2-(2-bromo-4-ethylphenoxy)-N-(2-phenylpropyl)acetamide has a molecular weight of 376.29 g/mol, XLogP of 4.31, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-bromo-4-ethylphenoxy)-N-(2-phenylpropyl)acetamide is sourced from PubChem (CID 133164493), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).