N-(2-bromophenyl)-2-[[6-(methylaminomethyl)-3-pyridinyl]oxy]acetamide

C15H16BrN3O2 — CID 79781844

IUPACN-(2-bromophenyl)-2-[[6-(methylaminomethyl)-3-pyridinyl]oxy]acetamide
SMILESCNCc1ccc(OCC(=O)Nc2ccccc2Br)cn1
InChIInChI=1S/C15H16BrN3O2/c1-17-8-11-6-7-12(9-18-11)21-10-15(20)19-14-5-3-2-4-13(14)16/h2-7,9,17H,8,10H2,1H3,(H,19,20)
InChIKeyXWNSMHPWQXRKFB-UHFFFAOYSA-N
MW350.22 g/mol
LogP2.58
Rot. Bonds6

About N-(2-bromophenyl)-2-[[6-(methylaminomethyl)-3-pyridinyl]oxy]acetamide

N-(2-bromophenyl)-2-[[6-(methylaminomethyl)-3-pyridinyl]oxy]acetamide (PubChem CID 79781844) has the molecular formula C15H16BrN3O2 and a molecular weight of 350.22 g/mol. Its IUPAC name is N-(2-bromophenyl)-2-[[6-(methylaminomethyl)-3-pyridinyl]oxy]acetamide.

Molecular Properties

Compound NameN-(2-bromophenyl)-2-[[6-(methylaminomethyl)-3-pyridinyl]oxy]acetamide
PubChem CID79781844
Molecular FormulaC15H16BrN3O2
Molecular Weight350.22 g/mol
Exact Mass349.04
IUPAC NameN-(2-bromophenyl)-2-[[6-(methylaminomethyl)-3-pyridinyl]oxy]acetamide
SMILESCNCc1ccc(OCC(=O)Nc2ccccc2Br)cn1
InChIInChI=1S/C15H16BrN3O2/c1-17-8-11-6-7-12(9-18-11)21-10-15(20)19-14-5-3-2-4-13(14)16/h2-7,9,17H,8,10H2,1H3,(H,19,20)
InChIKeyXWNSMHPWQXRKFB-UHFFFAOYSA-N
XLogP2.58
TPSA63.25 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500350.22
LogP ≤ 52.58
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2-bromophenyl)-2-(4-propoxyphenoxy)acetamide
CID 42989399
N-(2-bromophenyl)-2-(4-phenylphenoxy)acetamide
CID 1193865
N-(2-bromophenyl)-2-[4-[(2S)-butan-2-yl]phenoxy]acetamide
CID 40666712
N-(2-bromophenyl)-2-(4-propylphenoxy)acetamide
CID 19180395
N-(2-bromophenyl)-2-(4-formylphenoxy)acetamide
CID 23410083
N-(2-bromophenyl)-2-(3-fluoro-4-methylphenoxy)acetamide
CID 107171288
5-[2-(2-bromoanilino)-2-oxoethoxy]pyridine-3-carboxylic acid
CID 63851160
N-(2-bromophenyl)-2-(1-propylpyrazol-4-yl)oxyacetamide
CID 116805188
N-(2-bromophenyl)-2-quinolin-6-yloxyacetamide
CID 112978725
N-(2-bromophenyl)-2-(3-methyl-4-propan-2-ylphenoxy)acetamide
CID 19180400
N-(2-bromophenyl)-2-(3-hydroxy-2-methylphenoxy)acetamide
CID 43143290
N-(2-bromophenyl)-2-quinoxalin-2-yloxyacetamide
CID 2096177

Frequently Asked Questions

What is the IUPAC name of N-(2-bromophenyl)-2-[[6-(methylaminomethyl)-3-pyridinyl]oxy]acetamide?
The IUPAC name of N-(2-bromophenyl)-2-[[6-(methylaminomethyl)-3-pyridinyl]oxy]acetamide (CID 79781844) is N-(2-bromophenyl)-2-[[6-(methylaminomethyl)-3-pyridinyl]oxy]acetamide.
What is the SMILES notation for N-(2-bromophenyl)-2-[[6-(methylaminomethyl)-3-pyridinyl]oxy]acetamide?
The canonical SMILES for N-(2-bromophenyl)-2-[[6-(methylaminomethyl)-3-pyridinyl]oxy]acetamide is CNCc1ccc(OCC(=O)Nc2ccccc2Br)cn1.
What is the InChIKey of N-(2-bromophenyl)-2-[[6-(methylaminomethyl)-3-pyridinyl]oxy]acetamide?
The InChIKey is XWNSMHPWQXRKFB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16BrN3O2/c1-17-8-11-6-7-12(9-18-11)21-10-15(20)19-14-5-3-2-4-13(14)16/h2-7,9,17H,8,10H2,1H3,(H,19,20).
What are the key properties of N-(2-bromophenyl)-2-[[6-(methylaminomethyl)-3-pyridinyl]oxy]acetamide?
N-(2-bromophenyl)-2-[[6-(methylaminomethyl)-3-pyridinyl]oxy]acetamide has a molecular weight of 350.22 g/mol, XLogP of 2.58, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-bromophenyl)-2-[[6-(methylaminomethyl)-3-pyridinyl]oxy]acetamide is sourced from PubChem (CID 79781844), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).