N-(2-tert-butyl-4-pyridinyl)-2-(2-methoxyphenoxy)acetamide

C18H22N2O3 — CID 110443287

IUPACN-(2-tert-butyl-4-pyridinyl)-2-(2-methoxyphenoxy)acetamide
SMILESCOc1ccccc1OCC(=O)Nc1ccnc(C(C)(C)C)c1
InChIInChI=1S/C18H22N2O3/c1-18(2,3)16-11-13(9-10-19-16)20-17(21)12-23-15-8-6-5-7-14(15)22-4/h5-11H,12H2,1-4H3,(H,19,20,21)
InChIKeyXLLBUDZJQAFKHE-UHFFFAOYSA-N
MW314.38 g/mol
LogP3.41
Rot. Bonds5

About N-(2-tert-butyl-4-pyridinyl)-2-(2-methoxyphenoxy)acetamide

N-(2-tert-butyl-4-pyridinyl)-2-(2-methoxyphenoxy)acetamide (PubChem CID 110443287) has the molecular formula C18H22N2O3 and a molecular weight of 314.38 g/mol. Its IUPAC name is N-(2-tert-butyl-4-pyridinyl)-2-(2-methoxyphenoxy)acetamide.

Molecular Properties

Compound NameN-(2-tert-butyl-4-pyridinyl)-2-(2-methoxyphenoxy)acetamide
PubChem CID110443287
Molecular FormulaC18H22N2O3
Molecular Weight314.38 g/mol
Exact Mass314.16
IUPAC NameN-(2-tert-butyl-4-pyridinyl)-2-(2-methoxyphenoxy)acetamide
SMILESCOc1ccccc1OCC(=O)Nc1ccnc(C(C)(C)C)c1
InChIInChI=1S/C18H22N2O3/c1-18(2,3)16-11-13(9-10-19-16)20-17(21)12-23-15-8-6-5-7-14(15)22-4/h5-11H,12H2,1-4H3,(H,19,20,21)
InChIKeyXLLBUDZJQAFKHE-UHFFFAOYSA-N
XLogP3.41
TPSA60.45 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500314.38
LogP ≤ 53.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2-tert-butyl-4-pyridinyl)-2-(4-chlorophenoxy)acetamide
CID 110442677
2-(2-methoxyphenoxy)-N-(4-methylphenyl)acetamide
CID 675575
5-[[2-(2-methoxyphenoxy)acetyl]amino]benzene-1,3-dicarboxylic acid
CID 880340
N-(4-tert-butyl-1,3-thiazol-2-yl)-2-(2-methoxyphenoxy)acetamide
CID 2644525
N-tert-butyl-3-[[2-(2-methoxyphenoxy)acetyl]amino]benzamide
CID 9323551
N-tert-butyl-3,5-bis[[2-(2-methoxyphenoxy)acetyl]amino]benzamide
CID 2901481
2-(2-methoxyphenoxy)-N-(6-methoxy-3-pyridinyl)acetamide
CID 2677021
2-(2-aminophenoxy)-N-(2-methyl-4-pyridinyl)acetamide
CID 79234996
2-(2-ethoxyphenoxy)-N-pyridin-4-ylacetamide
CID 78802593
2-(2-tert-butylphenoxy)-N-(3,4,5-trimethoxyphenyl)acetamide
CID 24536655
N-[3-(dimethylsulfamoyl)phenyl]-2-(2-methoxyphenoxy)acetamide
CID 4797644
2-(2-methoxyphenoxy)-N-[4-(5-methyl-1H-pyrazol-3-yl)phenyl]acetamide
CID 110732585

Frequently Asked Questions

What is the IUPAC name of N-(2-tert-butyl-4-pyridinyl)-2-(2-methoxyphenoxy)acetamide?
The IUPAC name of N-(2-tert-butyl-4-pyridinyl)-2-(2-methoxyphenoxy)acetamide (CID 110443287) is N-(2-tert-butyl-4-pyridinyl)-2-(2-methoxyphenoxy)acetamide.
What is the SMILES notation for N-(2-tert-butyl-4-pyridinyl)-2-(2-methoxyphenoxy)acetamide?
The canonical SMILES for N-(2-tert-butyl-4-pyridinyl)-2-(2-methoxyphenoxy)acetamide is COc1ccccc1OCC(=O)Nc1ccnc(C(C)(C)C)c1.
What is the InChIKey of N-(2-tert-butyl-4-pyridinyl)-2-(2-methoxyphenoxy)acetamide?
The InChIKey is XLLBUDZJQAFKHE-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22N2O3/c1-18(2,3)16-11-13(9-10-19-16)20-17(21)12-23-15-8-6-5-7-14(15)22-4/h5-11H,12H2,1-4H3,(H,19,20,21).
What are the key properties of N-(2-tert-butyl-4-pyridinyl)-2-(2-methoxyphenoxy)acetamide?
N-(2-tert-butyl-4-pyridinyl)-2-(2-methoxyphenoxy)acetamide has a molecular weight of 314.38 g/mol, XLogP of 3.41, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-tert-butyl-4-pyridinyl)-2-(2-methoxyphenoxy)acetamide is sourced from PubChem (CID 110443287), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).