2-[acetyl(2-methoxyethyl)amino]-N-(4-tert-butylphenyl)acetamide

C17H26N2O3 — CID 113159904

IUPAC2-[acetyl(2-methoxyethyl)amino]-N-(4-tert-butylphenyl)acetamide
SMILESCOCCN(CC(=O)Nc1ccc(C(C)(C)C)cc1)C(C)=O
InChIInChI=1S/C17H26N2O3/c1-13(20)19(10-11-22-5)12-16(21)18-15-8-6-14(7-9-15)17(2,3)4/h6-9H,10-12H2,1-5H3,(H,18,21)
InChIKeyATZQPPSPVDTMFX-UHFFFAOYSA-N
MW306.41 g/mol
LogP2.42
Rot. Bonds6

About 2-[acetyl(2-methoxyethyl)amino]-N-(4-tert-butylphenyl)acetamide

2-[acetyl(2-methoxyethyl)amino]-N-(4-tert-butylphenyl)acetamide (PubChem CID 113159904) has the molecular formula C17H26N2O3 and a molecular weight of 306.41 g/mol. Its IUPAC name is 2-[acetyl(2-methoxyethyl)amino]-N-(4-tert-butylphenyl)acetamide.

Molecular Properties

Compound Name2-[acetyl(2-methoxyethyl)amino]-N-(4-tert-butylphenyl)acetamide
PubChem CID113159904
Molecular FormulaC17H26N2O3
Molecular Weight306.41 g/mol
Exact Mass306.19
IUPAC Name2-[acetyl(2-methoxyethyl)amino]-N-(4-tert-butylphenyl)acetamide
SMILESCOCCN(CC(=O)Nc1ccc(C(C)(C)C)cc1)C(C)=O
InChIInChI=1S/C17H26N2O3/c1-13(20)19(10-11-22-5)12-16(21)18-15-8-6-14(7-9-15)17(2,3)4/h6-9H,10-12H2,1-5H3,(H,18,21)
InChIKeyATZQPPSPVDTMFX-UHFFFAOYSA-N
XLogP2.42
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.41
LogP ≤ 52.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[acetyl(3-methoxypropyl)amino]-N-(4-tert-butylphenyl)acetamide
CID 113160101
2-[acetyl(3-methoxypropyl)amino]-N-(4-bromophenyl)acetamide
CID 113160115
2-[acetyl(2-methoxyethyl)amino]-N-(3-chloro-4-fluorophenyl)acetamide
CID 113159914
2-[acetyl-[2-(4-methoxyphenoxy)ethyl]amino]-N-(4-methoxyphenyl)acetamide
CID 113166031
2-[acetyl(2-methoxyethyl)amino]-N-(3,4,5-trimethoxyphenyl)acetamide
CID 113159965
2-[acetyl(2-morpholin-4-ylethyl)amino]-N-(4-tert-butylphenyl)acetamide
CID 113160686
2-[acetyl(2-methoxyethyl)amino]-N-[2-(trifluoromethyl)phenyl]acetamide
CID 113159931
2-[acetyl(3-methoxypropyl)amino]-N-(3-bromo-4-methylphenyl)acetamide
CID 113160116
3-[acetyl(3-methoxypropyl)amino]-N-[4-(trifluoromethyl)phenyl]propanamide
CID 113117197
N-(4-tert-butylphenyl)-2-(diethylamino)acetamide
CID 59866099
3-[acetyl(2-methoxyethyl)amino]-N-(4-cyanophenyl)propanamide
CID 113117060
2-[bis(2-methoxyethyl)amino]-N-(4-methoxyphenyl)acetamide
CID 33483504

Frequently Asked Questions

What is the IUPAC name of 2-[acetyl(2-methoxyethyl)amino]-N-(4-tert-butylphenyl)acetamide?
The IUPAC name of 2-[acetyl(2-methoxyethyl)amino]-N-(4-tert-butylphenyl)acetamide (CID 113159904) is 2-[acetyl(2-methoxyethyl)amino]-N-(4-tert-butylphenyl)acetamide.
What is the SMILES notation for 2-[acetyl(2-methoxyethyl)amino]-N-(4-tert-butylphenyl)acetamide?
The canonical SMILES for 2-[acetyl(2-methoxyethyl)amino]-N-(4-tert-butylphenyl)acetamide is COCCN(CC(=O)Nc1ccc(C(C)(C)C)cc1)C(C)=O.
What is the InChIKey of 2-[acetyl(2-methoxyethyl)amino]-N-(4-tert-butylphenyl)acetamide?
The InChIKey is ATZQPPSPVDTMFX-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N2O3/c1-13(20)19(10-11-22-5)12-16(21)18-15-8-6-14(7-9-15)17(2,3)4/h6-9H,10-12H2,1-5H3,(H,18,21).
What are the key properties of 2-[acetyl(2-methoxyethyl)amino]-N-(4-tert-butylphenyl)acetamide?
2-[acetyl(2-methoxyethyl)amino]-N-(4-tert-butylphenyl)acetamide has a molecular weight of 306.41 g/mol, XLogP of 2.42, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[acetyl(2-methoxyethyl)amino]-N-(4-tert-butylphenyl)acetamide is sourced from PubChem (CID 113159904), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).