N-(2-bromophenyl)-2-(4-propylphenoxy)acetamide

C17H18BrNO2 — CID 19180395

IUPACN-(2-bromophenyl)-2-(4-propylphenoxy)acetamide
SMILESCCCc1ccc(OCC(=O)Nc2ccccc2Br)cc1
InChIInChI=1S/C17H18BrNO2/c1-2-5-13-8-10-14(11-9-13)21-12-17(20)19-16-7-4-3-6-15(16)18/h3-4,6-11H,2,5,12H2,1H3,(H,19,20)
InChIKeyHRJKCBGNNLUACC-UHFFFAOYSA-N
MW348.24 g/mol
LogP4.42
Rot. Bonds6

About N-(2-bromophenyl)-2-(4-propylphenoxy)acetamide

N-(2-bromophenyl)-2-(4-propylphenoxy)acetamide (PubChem CID 19180395) has the molecular formula C17H18BrNO2 and a molecular weight of 348.24 g/mol. Its IUPAC name is N-(2-bromophenyl)-2-(4-propylphenoxy)acetamide.

Molecular Properties

Compound NameN-(2-bromophenyl)-2-(4-propylphenoxy)acetamide
PubChem CID19180395
Molecular FormulaC17H18BrNO2
Molecular Weight348.24 g/mol
Exact Mass347.05
IUPAC NameN-(2-bromophenyl)-2-(4-propylphenoxy)acetamide
SMILESCCCc1ccc(OCC(=O)Nc2ccccc2Br)cc1
InChIInChI=1S/C17H18BrNO2/c1-2-5-13-8-10-14(11-9-13)21-12-17(20)19-16-7-4-3-6-15(16)18/h3-4,6-11H,2,5,12H2,1H3,(H,19,20)
InChIKeyHRJKCBGNNLUACC-UHFFFAOYSA-N
XLogP4.42
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500348.24
LogP ≤ 54.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2-bromophenyl)-2-(4-propoxyphenoxy)acetamide
CID 42989399
N-(2-bromo-4-tert-butylphenyl)-2-(4-propylphenoxy)acetamide
CID 53268422
N-(2-bromophenyl)-2-(4-phenylphenoxy)acetamide
CID 1193865
N-(2-bromophenyl)-2-[4-[(2S)-butan-2-yl]phenoxy]acetamide
CID 40666712
N-(2-bromophenyl)-2-(4-formylphenoxy)acetamide
CID 23410083
N-(2-bromophenyl)-2-(3-fluoro-4-methylphenoxy)acetamide
CID 107171288
N-[2,5-dimethoxy-4-[[2-(4-propylphenoxy)acetyl]amino]phenyl]benzamide
CID 19180504
N-(2-bromophenyl)-2-[[6-(methylaminomethyl)-3-pyridinyl]oxy]acetamide
CID 79781844
N-(2-bromophenyl)-2-(1-propylpyrazol-4-yl)oxyacetamide
CID 116805188
2-(4-aminophenoxy)-N-(4-propylphenyl)acetamide
CID 61027141
N-(2-bromophenyl)-2-(3-methyl-4-propan-2-ylphenoxy)acetamide
CID 19180400
[2-(2-bromoanilino)-2-oxoethyl]-[(4-ethoxyphenyl)methyl]-methylazanium
CID 8799513

Frequently Asked Questions

What is the IUPAC name of N-(2-bromophenyl)-2-(4-propylphenoxy)acetamide?
The IUPAC name of N-(2-bromophenyl)-2-(4-propylphenoxy)acetamide (CID 19180395) is N-(2-bromophenyl)-2-(4-propylphenoxy)acetamide.
What is the SMILES notation for N-(2-bromophenyl)-2-(4-propylphenoxy)acetamide?
The canonical SMILES for N-(2-bromophenyl)-2-(4-propylphenoxy)acetamide is CCCc1ccc(OCC(=O)Nc2ccccc2Br)cc1.
What is the InChIKey of N-(2-bromophenyl)-2-(4-propylphenoxy)acetamide?
The InChIKey is HRJKCBGNNLUACC-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18BrNO2/c1-2-5-13-8-10-14(11-9-13)21-12-17(20)19-16-7-4-3-6-15(16)18/h3-4,6-11H,2,5,12H2,1H3,(H,19,20).
What are the key properties of N-(2-bromophenyl)-2-(4-propylphenoxy)acetamide?
N-(2-bromophenyl)-2-(4-propylphenoxy)acetamide has a molecular weight of 348.24 g/mol, XLogP of 4.42, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-bromophenyl)-2-(4-propylphenoxy)acetamide is sourced from PubChem (CID 19180395), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).