2-[[2-(tert-butylamino)-2-oxoethyl]-ethylamino]-N-(2-fluoro-4-methylphenyl)acetamide

C17H26FN3O2 — CID 8796724

IUPAC2-[[2-(tert-butylamino)-2-oxoethyl]-ethylamino]-N-(2-fluoro-4-methylphenyl)acetamide
SMILESCCN(CC(=O)Nc1ccc(C)cc1F)CC(=O)NC(C)(C)C
InChIInChI=1S/C17H26FN3O2/c1-6-21(11-16(23)20-17(3,4)5)10-15(22)19-14-8-7-12(2)9-13(14)18/h7-9H,6,10-11H2,1-5H3,(H,19,22)(H,20,23)
InChIKeyTUIQEBDNTOUNHT-UHFFFAOYSA-N
MW323.41 g/mol
LogP2.31
Rot. Bonds6

About 2-[[2-(tert-butylamino)-2-oxoethyl]-ethylamino]-N-(2-fluoro-4-methylphenyl)acetamide

2-[[2-(tert-butylamino)-2-oxoethyl]-ethylamino]-N-(2-fluoro-4-methylphenyl)acetamide (PubChem CID 8796724) has the molecular formula C17H26FN3O2 and a molecular weight of 323.41 g/mol. Its IUPAC name is 2-[[2-(tert-butylamino)-2-oxoethyl]-ethylamino]-N-(2-fluoro-4-methylphenyl)acetamide.

Molecular Properties

Compound Name2-[[2-(tert-butylamino)-2-oxoethyl]-ethylamino]-N-(2-fluoro-4-methylphenyl)acetamide
PubChem CID8796724
Molecular FormulaC17H26FN3O2
Molecular Weight323.41 g/mol
Exact Mass323.20
IUPAC Name2-[[2-(tert-butylamino)-2-oxoethyl]-ethylamino]-N-(2-fluoro-4-methylphenyl)acetamide
SMILESCCN(CC(=O)Nc1ccc(C)cc1F)CC(=O)NC(C)(C)C
InChIInChI=1S/C17H26FN3O2/c1-6-21(11-16(23)20-17(3,4)5)10-15(22)19-14-8-7-12(2)9-13(14)18/h7-9H,6,10-11H2,1-5H3,(H,19,22)(H,20,23)
InChIKeyTUIQEBDNTOUNHT-UHFFFAOYSA-N
XLogP2.31
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500323.41
LogP ≤ 52.31
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-fluoro-4-methylphenyl)propanamide
CID 60628124
2-(diethylamino)-N-(2,4-dimethylphenyl)acetamide
CID 28447
2-[[2-(tert-butylamino)-2-oxoethyl]-methylamino]-N-(2,4-dimethylphenyl)acetamide
CID 8756798
2-[[2-(5-chloro-2-methylanilino)-2-oxoethyl]-ethylamino]-N-(2,4-dimethylphenyl)acetamide
CID 8780400
N-(2,4-dimethylphenyl)-2-[ethyl-(2-hydroxy-2-methylpropyl)amino]acetamide
CID 78963407
2-[[2-(tert-butylamino)-2-oxoethyl]-ethylamino]-N-naphthalen-1-ylacetamide
CID 2450964
2-chloro-N-(2-fluoro-4-methylphenyl)acetamide
CID 2497550
N-(4-bromo-2-fluorophenyl)-2-[ethyl-[2-oxo-2-(propan-2-ylamino)ethyl]amino]acetamide
CID 2549434
2-[[2-(tert-butylamino)-2-oxoethyl]-ethylamino]-N-(4-chloro-2-methoxy-5-methylphenyl)acetamide
CID 27202310
N-(2-fluoro-4-methylphenyl)-2,2-dimethylpropanamide
CID 24898894
2-[2-aminoethyl(ethyl)amino]-N-(4-bromo-2-fluorophenyl)acetamide
CID 114231146
N-(4-chlorophenyl)-2-[[2-(2-fluoro-4-methylanilino)-2-oxoethyl]-methylamino]acetamide
CID 9167331

Frequently Asked Questions

What is the IUPAC name of 2-[[2-(tert-butylamino)-2-oxoethyl]-ethylamino]-N-(2-fluoro-4-methylphenyl)acetamide?
The IUPAC name of 2-[[2-(tert-butylamino)-2-oxoethyl]-ethylamino]-N-(2-fluoro-4-methylphenyl)acetamide (CID 8796724) is 2-[[2-(tert-butylamino)-2-oxoethyl]-ethylamino]-N-(2-fluoro-4-methylphenyl)acetamide.
What is the SMILES notation for 2-[[2-(tert-butylamino)-2-oxoethyl]-ethylamino]-N-(2-fluoro-4-methylphenyl)acetamide?
The canonical SMILES for 2-[[2-(tert-butylamino)-2-oxoethyl]-ethylamino]-N-(2-fluoro-4-methylphenyl)acetamide is CCN(CC(=O)Nc1ccc(C)cc1F)CC(=O)NC(C)(C)C.
What is the InChIKey of 2-[[2-(tert-butylamino)-2-oxoethyl]-ethylamino]-N-(2-fluoro-4-methylphenyl)acetamide?
The InChIKey is TUIQEBDNTOUNHT-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26FN3O2/c1-6-21(11-16(23)20-17(3,4)5)10-15(22)19-14-8-7-12(2)9-13(14)18/h7-9H,6,10-11H2,1-5H3,(H,19,22)(H,20,23).
What are the key properties of 2-[[2-(tert-butylamino)-2-oxoethyl]-ethylamino]-N-(2-fluoro-4-methylphenyl)acetamide?
2-[[2-(tert-butylamino)-2-oxoethyl]-ethylamino]-N-(2-fluoro-4-methylphenyl)acetamide has a molecular weight of 323.41 g/mol, XLogP of 2.31, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[2-(tert-butylamino)-2-oxoethyl]-ethylamino]-N-(2-fluoro-4-methylphenyl)acetamide is sourced from PubChem (CID 8796724), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).