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

C15H15BrN2O2 — CID 174683330

IUPAC2-(4-bromo-2-methoxyphenyl)-N-(3-methyl-2-pyridinyl)acetamide
SMILESCOc1cc(Br)ccc1CC(=O)Nc1ncccc1C
InChIInChI=1S/C15H15BrN2O2/c1-10-4-3-7-17-15(10)18-14(19)8-11-5-6-12(16)9-13(11)20-2/h3-7,9H,8H2,1-2H3,(H,17,18,19)
InChIKeyONTLGNPAPOWNPT-UHFFFAOYSA-N
MW335.20 g/mol
LogP3.34
Rot. Bonds4

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

2-(4-bromo-2-methoxyphenyl)-N-(3-methyl-2-pyridinyl)acetamide (PubChem CID 174683330) has the molecular formula C15H15BrN2O2 and a molecular weight of 335.20 g/mol. Its IUPAC name is 2-(4-bromo-2-methoxyphenyl)-N-(3-methyl-2-pyridinyl)acetamide.

Molecular Properties

Compound Name2-(4-bromo-2-methoxyphenyl)-N-(3-methyl-2-pyridinyl)acetamide
PubChem CID174683330
Molecular FormulaC15H15BrN2O2
Molecular Weight335.20 g/mol
Exact Mass334.03
IUPAC Name2-(4-bromo-2-methoxyphenyl)-N-(3-methyl-2-pyridinyl)acetamide
SMILESCOc1cc(Br)ccc1CC(=O)Nc1ncccc1C
InChIInChI=1S/C15H15BrN2O2/c1-10-4-3-7-17-15(10)18-14(19)8-11-5-6-12(16)9-13(11)20-2/h3-7,9H,8H2,1-2H3,(H,17,18,19)
InChIKeyONTLGNPAPOWNPT-UHFFFAOYSA-N
XLogP3.34
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500335.20
LogP ≤ 53.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(4-bromo-2-chlorophenoxy)-N-(3-methyl-2-pyridinyl)acetamide
CID 17173876
N-(5-bromo-3-methyl-2-pyridinyl)-2-(2-methoxyphenyl)acetamide
CID 81489105
2-(2-hydroxyphenyl)-N-(3-methyl-2-pyridinyl)acetamide
CID 60615989
5-bromo-2-methyl-N-(3-methyl-2-pyridinyl)benzamide
CID 65307070
2-(4-bromo-2-methoxyphenyl)-N-ethylacetamide;hydrochloride
CID 175415632
2-[2-(3,4-dimethoxyphenyl)-1,3-thiazol-4-yl]-N-(3-methyl-2-pyridinyl)acetamide
CID 55450669
2-(4-bromo-2-methoxyphenyl)-N-cyclobutylacetamide
CID 155293567
4-ethoxy-3-methoxy-N-(3-methyl-2-pyridinyl)benzamide
CID 25344175
2-methoxy-N-[3-[(3-methyl-2-pyridinyl)amino]-3-oxopropyl]benzamide
CID 24685535
3-bromo-4-methoxy-N-[(3-methyl-2-pyridinyl)carbamothioyl]benzamide
CID 1139159
N-(5-bromo-3-methyl-2-pyridinyl)-2-(2-methylphenyl)acetamide
CID 81489668
N-(5-bromo-2-methoxyphenyl)-2-(2-methoxyphenyl)acetamide
CID 55905124

Frequently Asked Questions

What is the IUPAC name of 2-(4-bromo-2-methoxyphenyl)-N-(3-methyl-2-pyridinyl)acetamide?
The IUPAC name of 2-(4-bromo-2-methoxyphenyl)-N-(3-methyl-2-pyridinyl)acetamide (CID 174683330) is 2-(4-bromo-2-methoxyphenyl)-N-(3-methyl-2-pyridinyl)acetamide.
What is the SMILES notation for 2-(4-bromo-2-methoxyphenyl)-N-(3-methyl-2-pyridinyl)acetamide?
The canonical SMILES for 2-(4-bromo-2-methoxyphenyl)-N-(3-methyl-2-pyridinyl)acetamide is COc1cc(Br)ccc1CC(=O)Nc1ncccc1C.
What is the InChIKey of 2-(4-bromo-2-methoxyphenyl)-N-(3-methyl-2-pyridinyl)acetamide?
The InChIKey is ONTLGNPAPOWNPT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15BrN2O2/c1-10-4-3-7-17-15(10)18-14(19)8-11-5-6-12(16)9-13(11)20-2/h3-7,9H,8H2,1-2H3,(H,17,18,19).
What are the key properties of 2-(4-bromo-2-methoxyphenyl)-N-(3-methyl-2-pyridinyl)acetamide?
2-(4-bromo-2-methoxyphenyl)-N-(3-methyl-2-pyridinyl)acetamide has a molecular weight of 335.20 g/mol, XLogP of 3.34, 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-methoxyphenyl)-N-(3-methyl-2-pyridinyl)acetamide is sourced from PubChem (CID 174683330), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).