2-[3-[[2-(2-tert-butylphenoxy)acetyl]amino]phenoxy]-N-ethylacetamide

C22H28N2O4 — CID 34870464

IUPAC2-[3-[[2-(2-tert-butylphenoxy)acetyl]amino]phenoxy]-N-ethylacetamide
SMILESCCNC(=O)COc1cccc(NC(=O)COc2ccccc2C(C)(C)C)c1
InChIInChI=1S/C22H28N2O4/c1-5-23-20(25)14-27-17-10-8-9-16(13-17)24-21(26)15-28-19-12-7-6-11-18(19)22(2,3)4/h6-13H,5,14-15H2,1-4H3,(H,23,25)(H,24,26)
InChIKeyRWRKKFKMXLWSDO-UHFFFAOYSA-N
MW384.48 g/mol
LogP3.52
Rot. Bonds8

About 2-[3-[[2-(2-tert-butylphenoxy)acetyl]amino]phenoxy]-N-ethylacetamide

2-[3-[[2-(2-tert-butylphenoxy)acetyl]amino]phenoxy]-N-ethylacetamide (PubChem CID 34870464) has the molecular formula C22H28N2O4 and a molecular weight of 384.48 g/mol. Its IUPAC name is 2-[3-[[2-(2-tert-butylphenoxy)acetyl]amino]phenoxy]-N-ethylacetamide.

Molecular Properties

Compound Name2-[3-[[2-(2-tert-butylphenoxy)acetyl]amino]phenoxy]-N-ethylacetamide
PubChem CID34870464
Molecular FormulaC22H28N2O4
Molecular Weight384.48 g/mol
Exact Mass384.20
IUPAC Name2-[3-[[2-(2-tert-butylphenoxy)acetyl]amino]phenoxy]-N-ethylacetamide
SMILESCCNC(=O)COc1cccc(NC(=O)COc2ccccc2C(C)(C)C)c1
InChIInChI=1S/C22H28N2O4/c1-5-23-20(25)14-27-17-10-8-9-16(13-17)24-21(26)15-28-19-12-7-6-11-18(19)22(2,3)4/h6-13H,5,14-15H2,1-4H3,(H,23,25)(H,24,26)
InChIKeyRWRKKFKMXLWSDO-UHFFFAOYSA-N
XLogP3.52
TPSA76.66 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500384.48
LogP ≤ 53.52
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[3-[[2-(2-tert-butylphenoxy)acetyl]amino]phenyl]-2-methylpropanamide
CID 17189278
2-(2,4-ditert-butylphenoxy)-N-(3-ethoxyphenyl)acetamide
CID 17098209
3-[[2-(2-tert-butylphenoxy)acetyl]amino]benzoate
CID 5123909
2-(2-tert-butylphenoxy)-N-[3-(pyridin-3-ylmethoxy)phenyl]acetamide
CID 55805039
ethyl N-[3-[2-(2-tert-butylanilino)-2-oxoethoxy]phenyl]carbamate
CID 29183042
2-(2,4-ditert-butylphenoxy)-N-(3-propoxyphenyl)acetamide
CID 17096794
4-tert-butyl-N-[2-[3-[2-(ethylamino)-2-oxoethoxy]anilino]-2-oxoethyl]benzamide
CID 39042630
N-[3-[2-(ethylamino)-2-oxoethoxy]phenyl]-2-(4-propanoylphenoxy)acetamide
CID 34875030
N-ethyl-2-[3-(methylamino)phenoxy]acetamide
CID 143296990
2-chloro-N-[3-[2-(ethylamino)-2-oxoethoxy]phenyl]benzamide
CID 39044160
2-(4-bromo-2-tert-butylphenoxy)-N-(3-methoxyphenyl)acetamide
CID 1184414
2-(2-tert-butylphenoxy)-N-(3,4,5-trimethoxyphenyl)acetamide
CID 24536655

Frequently Asked Questions

What is the IUPAC name of 2-[3-[[2-(2-tert-butylphenoxy)acetyl]amino]phenoxy]-N-ethylacetamide?
The IUPAC name of 2-[3-[[2-(2-tert-butylphenoxy)acetyl]amino]phenoxy]-N-ethylacetamide (CID 34870464) is 2-[3-[[2-(2-tert-butylphenoxy)acetyl]amino]phenoxy]-N-ethylacetamide.
What is the SMILES notation for 2-[3-[[2-(2-tert-butylphenoxy)acetyl]amino]phenoxy]-N-ethylacetamide?
The canonical SMILES for 2-[3-[[2-(2-tert-butylphenoxy)acetyl]amino]phenoxy]-N-ethylacetamide is CCNC(=O)COc1cccc(NC(=O)COc2ccccc2C(C)(C)C)c1.
What is the InChIKey of 2-[3-[[2-(2-tert-butylphenoxy)acetyl]amino]phenoxy]-N-ethylacetamide?
The InChIKey is RWRKKFKMXLWSDO-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H28N2O4/c1-5-23-20(25)14-27-17-10-8-9-16(13-17)24-21(26)15-28-19-12-7-6-11-18(19)22(2,3)4/h6-13H,5,14-15H2,1-4H3,(H,23,25)(H,24,26).
What are the key properties of 2-[3-[[2-(2-tert-butylphenoxy)acetyl]amino]phenoxy]-N-ethylacetamide?
2-[3-[[2-(2-tert-butylphenoxy)acetyl]amino]phenoxy]-N-ethylacetamide has a molecular weight of 384.48 g/mol, XLogP of 3.52, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-[[2-(2-tert-butylphenoxy)acetyl]amino]phenoxy]-N-ethylacetamide is sourced from PubChem (CID 34870464), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).