2-(4-bromo-2-chlorophenoxy)-N-(3-methyl-2-pyridinyl)acetamide

C14H12BrClN2O2 — CID 17173876

IUPAC2-(4-bromo-2-chlorophenoxy)-N-(3-methyl-2-pyridinyl)acetamide
SMILESCc1cccnc1NC(=O)COc1ccc(Br)cc1Cl
InChIInChI=1S/C14H12BrClN2O2/c1-9-3-2-6-17-14(9)18-13(19)8-20-12-5-4-10(15)7-11(12)16/h2-7H,8H2,1H3,(H,17,18,19)
InChIKeyGODFWYWROWIWJS-UHFFFAOYSA-N
MW355.62 g/mol
LogP3.82
Rot. Bonds4

About 2-(4-bromo-2-chlorophenoxy)-N-(3-methyl-2-pyridinyl)acetamide

2-(4-bromo-2-chlorophenoxy)-N-(3-methyl-2-pyridinyl)acetamide (PubChem CID 17173876) has the molecular formula C14H12BrClN2O2 and a molecular weight of 355.62 g/mol. Its IUPAC name is 2-(4-bromo-2-chlorophenoxy)-N-(3-methyl-2-pyridinyl)acetamide.

Molecular Properties

Compound Name2-(4-bromo-2-chlorophenoxy)-N-(3-methyl-2-pyridinyl)acetamide
PubChem CID17173876
Molecular FormulaC14H12BrClN2O2
Molecular Weight355.62 g/mol
Exact Mass353.98
IUPAC Name2-(4-bromo-2-chlorophenoxy)-N-(3-methyl-2-pyridinyl)acetamide
SMILESCc1cccnc1NC(=O)COc1ccc(Br)cc1Cl
InChIInChI=1S/C14H12BrClN2O2/c1-9-3-2-6-17-14(9)18-13(19)8-20-12-5-4-10(15)7-11(12)16/h2-7H,8H2,1H3,(H,17,18,19)
InChIKeyGODFWYWROWIWJS-UHFFFAOYSA-N
XLogP3.82
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500355.62
LogP ≤ 53.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(4-bromo-2-chlorophenoxy)-N-(2,6-dimethylphenyl)acetamide
CID 2230439
1-[3-(4-bromo-2-chlorophenoxy)propyl]-3-(3-methyl-2-pyridinyl)urea
CID 108882569
2-(4-bromo-2-methoxyphenyl)-N-(3-methyl-2-pyridinyl)acetamide
CID 174683330
2-(4-bromo-2-chlorophenoxy)-N-(1,3-thiazol-2-yl)acetamide
CID 833175
3-[[2-(4-bromo-2-chlorophenoxy)acetyl]amino]-4-methylbenzoic acid
CID 45429183
N-(5-bromo-2-methylphenyl)-2-(2-chlorophenoxy)acetamide
CID 55804154
2-(4-bromo-2-chlorophenoxy)-N-tert-butylacetamide
CID 885602
2-(2-chlorophenoxy)-N-(3-hydroxy-2-pyridinyl)acetamide
CID 18109429
2-(4-bromo-2-chlorophenoxy)-N-(5-propan-2-yl-1H-pyrazol-3-yl)acetamide
CID 115593026
2-(4-bromo-2-chlorophenoxy)-N'-[2-(2-methoxyphenoxy)acetyl]acetohydrazide
CID 4633037
2-(4-bromo-2-chlorophenoxy)-N-(2-phenylphenyl)acetamide
CID 2234948
2-[4-[[2-(4-bromo-2-chlorophenoxy)acetyl]amino]phenyl]-N-methylacetamide
CID 35365453

Frequently Asked Questions

What is the IUPAC name of 2-(4-bromo-2-chlorophenoxy)-N-(3-methyl-2-pyridinyl)acetamide?
The IUPAC name of 2-(4-bromo-2-chlorophenoxy)-N-(3-methyl-2-pyridinyl)acetamide (CID 17173876) is 2-(4-bromo-2-chlorophenoxy)-N-(3-methyl-2-pyridinyl)acetamide.
What is the SMILES notation for 2-(4-bromo-2-chlorophenoxy)-N-(3-methyl-2-pyridinyl)acetamide?
The canonical SMILES for 2-(4-bromo-2-chlorophenoxy)-N-(3-methyl-2-pyridinyl)acetamide is Cc1cccnc1NC(=O)COc1ccc(Br)cc1Cl.
What is the InChIKey of 2-(4-bromo-2-chlorophenoxy)-N-(3-methyl-2-pyridinyl)acetamide?
The InChIKey is GODFWYWROWIWJS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12BrClN2O2/c1-9-3-2-6-17-14(9)18-13(19)8-20-12-5-4-10(15)7-11(12)16/h2-7H,8H2,1H3,(H,17,18,19).
What are the key properties of 2-(4-bromo-2-chlorophenoxy)-N-(3-methyl-2-pyridinyl)acetamide?
2-(4-bromo-2-chlorophenoxy)-N-(3-methyl-2-pyridinyl)acetamide has a molecular weight of 355.62 g/mol, XLogP of 3.82, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-bromo-2-chlorophenoxy)-N-(3-methyl-2-pyridinyl)acetamide is sourced from PubChem (CID 17173876), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).