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

C16H16BrNO2 — CID 2268503

IUPAC2-(4-bromophenyl)-N-(4-ethoxyphenyl)acetamide
SMILESCCOc1ccc(NC(=O)Cc2ccc(Br)cc2)cc1
InChIInChI=1S/C16H16BrNO2/c1-2-20-15-9-7-14(8-10-15)18-16(19)11-12-3-5-13(17)6-4-12/h3-10H,2,11H2,1H3,(H,18,19)
InChIKeyDFTPRHRBZBJMKF-UHFFFAOYSA-N
MW334.21 g/mol
LogP4.03
Rot. Bonds5

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

2-(4-bromophenyl)-N-(4-ethoxyphenyl)acetamide (PubChem CID 2268503) has the molecular formula C16H16BrNO2 and a molecular weight of 334.21 g/mol. Its IUPAC name is 2-(4-bromophenyl)-N-(4-ethoxyphenyl)acetamide.

Molecular Properties

Compound Name2-(4-bromophenyl)-N-(4-ethoxyphenyl)acetamide
PubChem CID2268503
Molecular FormulaC16H16BrNO2
Molecular Weight334.21 g/mol
Exact Mass333.04
IUPAC Name2-(4-bromophenyl)-N-(4-ethoxyphenyl)acetamide
SMILESCCOc1ccc(NC(=O)Cc2ccc(Br)cc2)cc1
InChIInChI=1S/C16H16BrNO2/c1-2-20-15-9-7-14(8-10-15)18-16(19)11-12-3-5-13(17)6-4-12/h3-10H,2,11H2,1H3,(H,18,19)
InChIKeyDFTPRHRBZBJMKF-UHFFFAOYSA-N
XLogP4.03
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500334.21
LogP ≤ 54.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(4-bromophenyl)-N-(4-ethoxyphenyl)acetamide?
The IUPAC name of 2-(4-bromophenyl)-N-(4-ethoxyphenyl)acetamide (CID 2268503) is 2-(4-bromophenyl)-N-(4-ethoxyphenyl)acetamide.
What is the SMILES notation for 2-(4-bromophenyl)-N-(4-ethoxyphenyl)acetamide?
The canonical SMILES for 2-(4-bromophenyl)-N-(4-ethoxyphenyl)acetamide is CCOc1ccc(NC(=O)Cc2ccc(Br)cc2)cc1.
What is the InChIKey of 2-(4-bromophenyl)-N-(4-ethoxyphenyl)acetamide?
The InChIKey is DFTPRHRBZBJMKF-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16BrNO2/c1-2-20-15-9-7-14(8-10-15)18-16(19)11-12-3-5-13(17)6-4-12/h3-10H,2,11H2,1H3,(H,18,19).
What are the key properties of 2-(4-bromophenyl)-N-(4-ethoxyphenyl)acetamide?
2-(4-bromophenyl)-N-(4-ethoxyphenyl)acetamide has a molecular weight of 334.21 g/mol, XLogP of 4.03, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-bromophenyl)-N-(4-ethoxyphenyl)acetamide is sourced from PubChem (CID 2268503), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).