2-(2-tert-butylphenoxy)-N-[3-(pyridin-3-ylmethoxy)phenyl]acetamide

C24H26N2O3 — CID 55805039

IUPAC2-(2-tert-butylphenoxy)-N-[3-(pyridin-3-ylmethoxy)phenyl]acetamide
SMILESCC(C)(C)c1ccccc1OCC(=O)Nc1cccc(OCc2cccnc2)c1
InChIInChI=1S/C24H26N2O3/c1-24(2,3)21-11-4-5-12-22(21)29-17-23(27)26-19-9-6-10-20(14-19)28-16-18-8-7-13-25-15-18/h4-15H,16-17H2,1-3H3,(H,26,27)
InChIKeyWZPWADVZUFBVDE-UHFFFAOYSA-N
MW390.48 g/mol
LogP4.98
Rot. Bonds7

About 2-(2-tert-butylphenoxy)-N-[3-(pyridin-3-ylmethoxy)phenyl]acetamide

2-(2-tert-butylphenoxy)-N-[3-(pyridin-3-ylmethoxy)phenyl]acetamide (PubChem CID 55805039) has the molecular formula C24H26N2O3 and a molecular weight of 390.48 g/mol. Its IUPAC name is 2-(2-tert-butylphenoxy)-N-[3-(pyridin-3-ylmethoxy)phenyl]acetamide.

Molecular Properties

Compound Name2-(2-tert-butylphenoxy)-N-[3-(pyridin-3-ylmethoxy)phenyl]acetamide
PubChem CID55805039
Molecular FormulaC24H26N2O3
Molecular Weight390.48 g/mol
Exact Mass390.19
IUPAC Name2-(2-tert-butylphenoxy)-N-[3-(pyridin-3-ylmethoxy)phenyl]acetamide
SMILESCC(C)(C)c1ccccc1OCC(=O)Nc1cccc(OCc2cccnc2)c1
InChIInChI=1S/C24H26N2O3/c1-24(2,3)21-11-4-5-12-22(21)29-17-23(27)26-19-9-6-10-20(14-19)28-16-18-8-7-13-25-15-18/h4-15H,16-17H2,1-3H3,(H,26,27)
InChIKeyWZPWADVZUFBVDE-UHFFFAOYSA-N
XLogP4.98
TPSA60.45 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500390.48
LogP ≤ 54.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(2-methoxy-4-methylphenoxy)-N-[3-(pyridin-3-ylmethoxy)phenyl]acetamide
CID 55804685
2-[3-[[2-(2-tert-butylphenoxy)acetyl]amino]phenoxy]-N-ethylacetamide
CID 34870464
2-amino-2-methyl-N-[3-(pyridin-3-ylmethoxy)phenyl]propanamide;dihydrochloride
CID 119846147
2-(4-phenylphenyl)-N-[3-(pyridin-3-ylmethoxy)phenyl]acetamide
CID 52655964
N-naphthalen-2-yl-2-[4-(pyridin-3-ylmethoxy)phenoxy]acetamide
CID 71939692
N-[3-[[2-(2-tert-butylphenoxy)acetyl]amino]phenyl]-2-methylpropanamide
CID 17189278
3-amino-N-[3-(pyridin-3-ylmethoxy)phenyl]butanamide;dihydrochloride
CID 119846183
N-pyridin-3-yl-2-[2-(trifluoromethyl)phenoxy]acetamide
CID 75414453
3-[[2-(2-tert-butylphenoxy)acetyl]amino]benzoate
CID 5123909
1-[2-(2-tert-butylphenoxy)-3-pyridinyl]-3-(3-phenylmethoxyphenyl)urea
CID 68533651
2-methyl-3-(methylamino)-N-[3-(pyridin-3-ylmethoxy)phenyl]propanamide;dihydrochloride
CID 119846173
2-(cyclopropylmethylamino)-N-[3-(pyridin-3-ylmethoxy)phenyl]acetamide
CID 119846170

Frequently Asked Questions

What is the IUPAC name of 2-(2-tert-butylphenoxy)-N-[3-(pyridin-3-ylmethoxy)phenyl]acetamide?
The IUPAC name of 2-(2-tert-butylphenoxy)-N-[3-(pyridin-3-ylmethoxy)phenyl]acetamide (CID 55805039) is 2-(2-tert-butylphenoxy)-N-[3-(pyridin-3-ylmethoxy)phenyl]acetamide.
What is the SMILES notation for 2-(2-tert-butylphenoxy)-N-[3-(pyridin-3-ylmethoxy)phenyl]acetamide?
The canonical SMILES for 2-(2-tert-butylphenoxy)-N-[3-(pyridin-3-ylmethoxy)phenyl]acetamide is CC(C)(C)c1ccccc1OCC(=O)Nc1cccc(OCc2cccnc2)c1.
What is the InChIKey of 2-(2-tert-butylphenoxy)-N-[3-(pyridin-3-ylmethoxy)phenyl]acetamide?
The InChIKey is WZPWADVZUFBVDE-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H26N2O3/c1-24(2,3)21-11-4-5-12-22(21)29-17-23(27)26-19-9-6-10-20(14-19)28-16-18-8-7-13-25-15-18/h4-15H,16-17H2,1-3H3,(H,26,27).
What are the key properties of 2-(2-tert-butylphenoxy)-N-[3-(pyridin-3-ylmethoxy)phenyl]acetamide?
2-(2-tert-butylphenoxy)-N-[3-(pyridin-3-ylmethoxy)phenyl]acetamide has a molecular weight of 390.48 g/mol, XLogP of 4.98, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-tert-butylphenoxy)-N-[3-(pyridin-3-ylmethoxy)phenyl]acetamide is sourced from PubChem (CID 55805039), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).