2-[1-(4-ethylphenyl)ethylamino]-N-methylacetamide

C13H20N2O — CID 43214669

IUPAC2-[1-(4-ethylphenyl)ethylamino]-N-methylacetamide
SMILESCCc1ccc(C(C)NCC(=O)NC)cc1
InChIInChI=1S/C13H20N2O/c1-4-11-5-7-12(8-6-11)10(2)15-9-13(16)14-3/h5-8,10,15H,4,9H2,1-3H3,(H,14,16)
InChIKeyQPHZXGFDAVIHMG-UHFFFAOYSA-N
MW220.32 g/mol
LogP1.65
Rot. Bonds5

About 2-[1-(4-ethylphenyl)ethylamino]-N-methylacetamide

2-[1-(4-ethylphenyl)ethylamino]-N-methylacetamide (PubChem CID 43214669) has the molecular formula C13H20N2O and a molecular weight of 220.32 g/mol. Its IUPAC name is 2-[1-(4-ethylphenyl)ethylamino]-N-methylacetamide.

Molecular Properties

Compound Name2-[1-(4-ethylphenyl)ethylamino]-N-methylacetamide
PubChem CID43214669
Molecular FormulaC13H20N2O
Molecular Weight220.32 g/mol
Exact Mass220.16
IUPAC Name2-[1-(4-ethylphenyl)ethylamino]-N-methylacetamide
SMILESCCc1ccc(C(C)NCC(=O)NC)cc1
InChIInChI=1S/C13H20N2O/c1-4-11-5-7-12(8-6-11)10(2)15-9-13(16)14-3/h5-8,10,15H,4,9H2,1-3H3,(H,14,16)
InChIKeyQPHZXGFDAVIHMG-UHFFFAOYSA-N
XLogP1.65
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.32
LogP ≤ 51.65
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-butan-2-yl-2-[1-(4-ethylphenyl)ethylamino]acetamide
CID 60693867
2-[1-(4-ethylphenyl)ethylamino]-N-pentan-2-ylacetamide
CID 60693789
2-[1-(4-chlorophenyl)ethylamino]-N-methylacetamide
CID 43214679
2-[[(1S)-1-(4-chlorophenyl)ethyl]amino]-N-[(1R)-1-(4-ethylphenyl)ethyl]acetamide
CID 8636133
2-[1-(4-ethoxyphenyl)ethylamino]-N-methylacetamide
CID 43215162
N-methyl-2-[1-(4-phenylphenyl)ethylamino]acetamide
CID 43214687
2-[[(1S)-1-(4-methoxyphenyl)ethyl]amino]-N-methylacetamide
CID 81371329
2-[1-(4-ethylphenyl)ethylamino]-N-methylpropanamide
CID 60674323
N-ethyl-2-[1-(4-ethylphenyl)ethylamino]-N-methylacetamide
CID 60759691
N-[(3,5-difluorophenyl)methyl]-2-[1-(4-ethylphenyl)ethylamino]acetamide
CID 112840376
methyl 4-[[1-(4-ethylphenyl)ethylamino]methyl]benzoate
CID 119137995
2-[1-(4-ethylphenyl)ethylamino]-N-[(1-phenylcyclopropyl)methyl]acetamide
CID 112810943

Frequently Asked Questions

What is the IUPAC name of 2-[1-(4-ethylphenyl)ethylamino]-N-methylacetamide?
The IUPAC name of 2-[1-(4-ethylphenyl)ethylamino]-N-methylacetamide (CID 43214669) is 2-[1-(4-ethylphenyl)ethylamino]-N-methylacetamide.
What is the SMILES notation for 2-[1-(4-ethylphenyl)ethylamino]-N-methylacetamide?
The canonical SMILES for 2-[1-(4-ethylphenyl)ethylamino]-N-methylacetamide is CCc1ccc(C(C)NCC(=O)NC)cc1.
What is the InChIKey of 2-[1-(4-ethylphenyl)ethylamino]-N-methylacetamide?
The InChIKey is QPHZXGFDAVIHMG-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2O/c1-4-11-5-7-12(8-6-11)10(2)15-9-13(16)14-3/h5-8,10,15H,4,9H2,1-3H3,(H,14,16).
What are the key properties of 2-[1-(4-ethylphenyl)ethylamino]-N-methylacetamide?
2-[1-(4-ethylphenyl)ethylamino]-N-methylacetamide has a molecular weight of 220.32 g/mol, XLogP of 1.65, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-(4-ethylphenyl)ethylamino]-N-methylacetamide is sourced from PubChem (CID 43214669), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).