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

C16H17BrN2O2 — CID 7535577

IUPAC2-(4-bromoanilino)-N-(2-ethoxyphenyl)acetamide
SMILESCCOc1ccccc1NC(=O)CNc1ccc(Br)cc1
InChIInChI=1S/C16H17BrN2O2/c1-2-21-15-6-4-3-5-14(15)19-16(20)11-18-13-9-7-12(17)8-10-13/h3-10,18H,2,11H2,1H3,(H,19,20)
InChIKeyYXIPJGPWGPATMX-UHFFFAOYSA-N
MW349.23 g/mol
LogP3.90
Rot. Bonds6

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

2-(4-bromoanilino)-N-(2-ethoxyphenyl)acetamide (PubChem CID 7535577) has the molecular formula C16H17BrN2O2 and a molecular weight of 349.23 g/mol. Its IUPAC name is 2-(4-bromoanilino)-N-(2-ethoxyphenyl)acetamide.

Molecular Properties

Compound Name2-(4-bromoanilino)-N-(2-ethoxyphenyl)acetamide
PubChem CID7535577
Molecular FormulaC16H17BrN2O2
Molecular Weight349.23 g/mol
Exact Mass348.05
IUPAC Name2-(4-bromoanilino)-N-(2-ethoxyphenyl)acetamide
SMILESCCOc1ccccc1NC(=O)CNc1ccc(Br)cc1
InChIInChI=1S/C16H17BrN2O2/c1-2-21-15-6-4-3-5-14(15)19-16(20)11-18-13-9-7-12(17)8-10-13/h3-10,18H,2,11H2,1H3,(H,19,20)
InChIKeyYXIPJGPWGPATMX-UHFFFAOYSA-N
XLogP3.90
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500349.23
LogP ≤ 53.90
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(4-bromoanilino)-N-(2-prop-2-enoxyphenyl)acetamide
CID 54811194
ethyl 4-[[2-(2-ethoxyanilino)-2-oxoethyl]amino]benzoate
CID 51178437
N-(2-ethoxyphenyl)-2-[4-(2-methoxyethoxy)anilino]acetamide
CID 54822263
2-(4-bromoanilino)-N-(3,4-diethoxyphenyl)acetamide
CID 9080322
2-[(4-bromophenyl)methylsulfonylamino]-N-(2-ethoxyphenyl)acetamide
CID 22299888
2-[[(1S)-1-(4-bromophenyl)propyl]amino]-N-(2-ethoxyphenyl)acetamide
CID 9263568
2-anilino-N-(2-propoxyphenyl)acetamide
CID 51286142
2-[4-(azepane-1-carbonyl)anilino]-N-(2-ethoxyphenyl)acetamide
CID 54835054
N-[3-[[2-(2-ethoxyanilino)-2-oxoethyl]amino]-4-methylphenyl]propanamide
CID 55892840
3-(3-bromo-4-methylanilino)-N-(2-ethoxyphenyl)propanamide
CID 109039314
N-(2-ethoxyphenyl)-2-[4-(morpholine-4-carbonyl)anilino]acetamide
CID 54831932
N-(2-ethoxyphenyl)-2-[2-(2-phenoxyethoxy)anilino]acetamide
CID 54827090

Frequently Asked Questions

What is the IUPAC name of 2-(4-bromoanilino)-N-(2-ethoxyphenyl)acetamide?
The IUPAC name of 2-(4-bromoanilino)-N-(2-ethoxyphenyl)acetamide (CID 7535577) is 2-(4-bromoanilino)-N-(2-ethoxyphenyl)acetamide.
What is the SMILES notation for 2-(4-bromoanilino)-N-(2-ethoxyphenyl)acetamide?
The canonical SMILES for 2-(4-bromoanilino)-N-(2-ethoxyphenyl)acetamide is CCOc1ccccc1NC(=O)CNc1ccc(Br)cc1.
What is the InChIKey of 2-(4-bromoanilino)-N-(2-ethoxyphenyl)acetamide?
The InChIKey is YXIPJGPWGPATMX-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17BrN2O2/c1-2-21-15-6-4-3-5-14(15)19-16(20)11-18-13-9-7-12(17)8-10-13/h3-10,18H,2,11H2,1H3,(H,19,20).
What are the key properties of 2-(4-bromoanilino)-N-(2-ethoxyphenyl)acetamide?
2-(4-bromoanilino)-N-(2-ethoxyphenyl)acetamide has a molecular weight of 349.23 g/mol, XLogP of 3.90, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-bromoanilino)-N-(2-ethoxyphenyl)acetamide is sourced from PubChem (CID 7535577), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).