N-(2-bromophenyl)-2-(3-hydroxy-2-methylphenoxy)acetamide

C15H14BrNO3 — CID 43143290

IUPACN-(2-bromophenyl)-2-(3-hydroxy-2-methylphenoxy)acetamide
SMILESCc1c(O)cccc1OCC(=O)Nc1ccccc1Br
InChIInChI=1S/C15H14BrNO3/c1-10-13(18)7-4-8-14(10)20-9-15(19)17-12-6-3-2-5-11(12)16/h2-8,18H,9H2,1H3,(H,17,19)
InChIKeyJQKCLUQWJVUTDY-UHFFFAOYSA-N
MW336.19 g/mol
LogP3.48
Rot. Bonds4

About N-(2-bromophenyl)-2-(3-hydroxy-2-methylphenoxy)acetamide

N-(2-bromophenyl)-2-(3-hydroxy-2-methylphenoxy)acetamide (PubChem CID 43143290) has the molecular formula C15H14BrNO3 and a molecular weight of 336.19 g/mol. Its IUPAC name is N-(2-bromophenyl)-2-(3-hydroxy-2-methylphenoxy)acetamide.

Molecular Properties

Compound NameN-(2-bromophenyl)-2-(3-hydroxy-2-methylphenoxy)acetamide
PubChem CID43143290
Molecular FormulaC15H14BrNO3
Molecular Weight336.19 g/mol
Exact Mass335.02
IUPAC NameN-(2-bromophenyl)-2-(3-hydroxy-2-methylphenoxy)acetamide
SMILESCc1c(O)cccc1OCC(=O)Nc1ccccc1Br
InChIInChI=1S/C15H14BrNO3/c1-10-13(18)7-4-8-14(10)20-9-15(19)17-12-6-3-2-5-11(12)16/h2-8,18H,9H2,1H3,(H,17,19)
InChIKeyJQKCLUQWJVUTDY-UHFFFAOYSA-N
XLogP3.48
TPSA58.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500336.19
LogP ≤ 53.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-bromophenyl)-2-[[2-(2-methylphenoxy)acetyl]amino]acetamide
CID 8503107
[2-(2-bromoanilino)-2-oxoethyl] 2-(2-methylphenoxy)acetate
CID 2555539
2-[2-(aminomethyl)-4-methylphenoxy]-N-(2-bromophenyl)acetamide
CID 63322380
2-[2-bromo-4-(hydroxymethyl)phenoxy]-N-(2-bromophenyl)acetamide
CID 63052653
2-(2-bromophenoxy)-N-(2-tert-butylphenyl)acetamide
CID 31277256
2-(2,3-dimethylphenoxy)-N-naphthalen-1-ylacetamide
CID 720683
2-(2,3-dimethylphenoxy)-N-(2-fluorophenyl)acetamide
CID 720662
2-(2-amino-4-fluorophenoxy)-N-(2-bromophenyl)acetamide
CID 62368515
N-(2-bromophenyl)-2-(2,4-dibromo-6-methylphenoxy)acetamide
CID 3249849
3-amino-N-[2-[[2-(2,3-dimethylphenoxy)acetyl]amino]phenyl]propanamide
CID 82034375
2-(4-acetyl-2-methoxyphenoxy)-N-(2-bromophenyl)acetamide
CID 26536729
N-(2-ethoxyphenyl)-2-(2-hydroxyphenoxy)acetamide
CID 78768376

Frequently Asked Questions

What is the IUPAC name of N-(2-bromophenyl)-2-(3-hydroxy-2-methylphenoxy)acetamide?
The IUPAC name of N-(2-bromophenyl)-2-(3-hydroxy-2-methylphenoxy)acetamide (CID 43143290) is N-(2-bromophenyl)-2-(3-hydroxy-2-methylphenoxy)acetamide.
What is the SMILES notation for N-(2-bromophenyl)-2-(3-hydroxy-2-methylphenoxy)acetamide?
The canonical SMILES for N-(2-bromophenyl)-2-(3-hydroxy-2-methylphenoxy)acetamide is Cc1c(O)cccc1OCC(=O)Nc1ccccc1Br.
What is the InChIKey of N-(2-bromophenyl)-2-(3-hydroxy-2-methylphenoxy)acetamide?
The InChIKey is JQKCLUQWJVUTDY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14BrNO3/c1-10-13(18)7-4-8-14(10)20-9-15(19)17-12-6-3-2-5-11(12)16/h2-8,18H,9H2,1H3,(H,17,19).
What are the key properties of N-(2-bromophenyl)-2-(3-hydroxy-2-methylphenoxy)acetamide?
N-(2-bromophenyl)-2-(3-hydroxy-2-methylphenoxy)acetamide has a molecular weight of 336.19 g/mol, XLogP of 3.48, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-bromophenyl)-2-(3-hydroxy-2-methylphenoxy)acetamide is sourced from PubChem (CID 43143290), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).