N-ethyl-2-[[2-[4-(2-methylbutan-2-yl)phenoxy]acetyl]amino]benzamide

C22H28N2O3 — CID 17093296

IUPACN-ethyl-2-[[2-[4-(2-methylbutan-2-yl)phenoxy]acetyl]amino]benzamide
SMILESCCNC(=O)c1ccccc1NC(=O)COc1ccc(C(C)(C)CC)cc1
InChIInChI=1S/C22H28N2O3/c1-5-22(3,4)16-11-13-17(14-12-16)27-15-20(25)24-19-10-8-7-9-18(19)21(26)23-6-2/h7-14H,5-6,15H2,1-4H3,(H,23,26)(H,24,25)
InChIKeyIHPJJROWRXUYQD-UHFFFAOYSA-N
MW368.48 g/mol
LogP4.14
Rot. Bonds8

About N-ethyl-2-[[2-[4-(2-methylbutan-2-yl)phenoxy]acetyl]amino]benzamide

N-ethyl-2-[[2-[4-(2-methylbutan-2-yl)phenoxy]acetyl]amino]benzamide (PubChem CID 17093296) has the molecular formula C22H28N2O3 and a molecular weight of 368.48 g/mol. Its IUPAC name is N-ethyl-2-[[2-[4-(2-methylbutan-2-yl)phenoxy]acetyl]amino]benzamide.

Molecular Properties

Compound NameN-ethyl-2-[[2-[4-(2-methylbutan-2-yl)phenoxy]acetyl]amino]benzamide
PubChem CID17093296
Molecular FormulaC22H28N2O3
Molecular Weight368.48 g/mol
Exact Mass368.21
IUPAC NameN-ethyl-2-[[2-[4-(2-methylbutan-2-yl)phenoxy]acetyl]amino]benzamide
SMILESCCNC(=O)c1ccccc1NC(=O)COc1ccc(C(C)(C)CC)cc1
InChIInChI=1S/C22H28N2O3/c1-5-22(3,4)16-11-13-17(14-12-16)27-15-20(25)24-19-10-8-7-9-18(19)21(26)23-6-2/h7-14H,5-6,15H2,1-4H3,(H,23,26)(H,24,25)
InChIKeyIHPJJROWRXUYQD-UHFFFAOYSA-N
XLogP4.14
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500368.48
LogP ≤ 54.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-fluorophenyl)-2-[4-(2-methylbutan-2-yl)phenoxy]acetamide
CID 17093259
2-[4-(2-methylbutan-2-yl)phenoxy]-N-[2-(pyrrolidine-1-carbonyl)phenyl]acetamide
CID 17093269
N-(2-ethoxyphenyl)-2-[4-(2-methylbutan-2-yl)phenoxy]acetamide
CID 17341028
N-cyclohexyl-N-methyl-2-[[2-[4-(2-methylbutan-2-yl)phenoxy]acetyl]amino]benzamide
CID 17093283
2-[[2-(2-bromo-4-tert-butylphenoxy)acetyl]amino]-N-ethylbenzamide
CID 17350181
2-[[2-(4-bromophenoxy)acetyl]amino]-N-propylbenzamide
CID 4945967
4-[[2-[[2-(4-tert-butylphenoxy)acetyl]amino]benzoyl]amino]benzoic acid
CID 1230927
N-(4-anilinophenyl)-2-[4-(2-methylbutan-2-yl)phenoxy]acetamide
CID 17093194
2-[4-(2-methylbutan-2-yl)phenoxy]-N-[4-(2-phenoxyethoxy)phenyl]acetamide
CID 17093306
N-butyl-2-[[2-(4-methoxyphenoxy)acetyl]amino]benzamide
CID 17149354
N-(4-fluorophenyl)-2-[4-(2-methylbutan-2-yl)phenoxy]acetamide
CID 17093193
N'-[2-[4-(2-methylbutan-2-yl)phenoxy]acetyl]-2-nitrobenzohydrazide
CID 17093334

Frequently Asked Questions

What is the IUPAC name of N-ethyl-2-[[2-[4-(2-methylbutan-2-yl)phenoxy]acetyl]amino]benzamide?
The IUPAC name of N-ethyl-2-[[2-[4-(2-methylbutan-2-yl)phenoxy]acetyl]amino]benzamide (CID 17093296) is N-ethyl-2-[[2-[4-(2-methylbutan-2-yl)phenoxy]acetyl]amino]benzamide.
What is the SMILES notation for N-ethyl-2-[[2-[4-(2-methylbutan-2-yl)phenoxy]acetyl]amino]benzamide?
The canonical SMILES for N-ethyl-2-[[2-[4-(2-methylbutan-2-yl)phenoxy]acetyl]amino]benzamide is CCNC(=O)c1ccccc1NC(=O)COc1ccc(C(C)(C)CC)cc1.
What is the InChIKey of N-ethyl-2-[[2-[4-(2-methylbutan-2-yl)phenoxy]acetyl]amino]benzamide?
The InChIKey is IHPJJROWRXUYQD-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H28N2O3/c1-5-22(3,4)16-11-13-17(14-12-16)27-15-20(25)24-19-10-8-7-9-18(19)21(26)23-6-2/h7-14H,5-6,15H2,1-4H3,(H,23,26)(H,24,25).
What are the key properties of N-ethyl-2-[[2-[4-(2-methylbutan-2-yl)phenoxy]acetyl]amino]benzamide?
N-ethyl-2-[[2-[4-(2-methylbutan-2-yl)phenoxy]acetyl]amino]benzamide has a molecular weight of 368.48 g/mol, XLogP of 4.14, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-[[2-[4-(2-methylbutan-2-yl)phenoxy]acetyl]amino]benzamide is sourced from PubChem (CID 17093296), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).