N-ethyl-N-(4-methylphenyl)-2-propoxyacetamide

C14H21NO2 — CID 113227387

IUPACN-ethyl-N-(4-methylphenyl)-2-propoxyacetamide
SMILESCCCOCC(=O)N(CC)c1ccc(C)cc1
InChIInChI=1S/C14H21NO2/c1-4-10-17-11-14(16)15(5-2)13-8-6-12(3)7-9-13/h6-9H,4-5,10-11H2,1-3H3
InChIKeyAPJRUEYOODROTE-UHFFFAOYSA-N
MW235.33 g/mol
LogP2.77
Rot. Bonds6

About N-ethyl-N-(4-methylphenyl)-2-propoxyacetamide

N-ethyl-N-(4-methylphenyl)-2-propoxyacetamide (PubChem CID 113227387) has the molecular formula C14H21NO2 and a molecular weight of 235.33 g/mol. Its IUPAC name is N-ethyl-N-(4-methylphenyl)-2-propoxyacetamide.

Molecular Properties

Compound NameN-ethyl-N-(4-methylphenyl)-2-propoxyacetamide
PubChem CID113227387
Molecular FormulaC14H21NO2
Molecular Weight235.33 g/mol
Exact Mass235.16
IUPAC NameN-ethyl-N-(4-methylphenyl)-2-propoxyacetamide
SMILESCCCOCC(=O)N(CC)c1ccc(C)cc1
InChIInChI=1S/C14H21NO2/c1-4-10-17-11-14(16)15(5-2)13-8-6-12(3)7-9-13/h6-9H,4-5,10-11H2,1-3H3
InChIKeyAPJRUEYOODROTE-UHFFFAOYSA-N
XLogP2.77
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.33
LogP ≤ 52.77
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

2-(2-aminoethoxy)-N-ethyl-N-(4-methylphenyl)acetamide
CID 79479435
N-ethyl-2-[2-(N-ethylanilino)-2-oxoethoxy]-N-phenylacetamide
CID 52563694
ethane;N-ethyl-N-(4-methylphenyl)acetamide
CID 143607666
N-ethyl-N-(4-methylphenyl)-3-sulfanylpropanamide
CID 107027712
2-[2-(2-methoxyethoxy)ethoxy]-N-methyl-N-(4-methylphenyl)acetamide
CID 143038199
3-(diethylamino)-N-(2-ethoxyethyl)-N-(4-methylphenyl)propanamide
CID 58662238
N-ethyl-2-methyl-N-(4-methylphenyl)propanamide
CID 60737044
2-(2-methoxyethoxy)-N-[(4-methylphenyl)methyl]-N-propylacetamide
CID 103602434
2-[2-(aminomethyl)phenyl]-N-ethyl-N-(4-methylphenyl)acetamide
CID 81312467
2-(2-aminoethoxy)-N-ethyl-N-(3-hydroxyphenyl)acetamide
CID 107734931
(2R)-2-amino-N-ethyl-N-(4-methylphenyl)propanamide
CID 78979225
N-(4-chlorophenyl)-N-ethyl-2-[(E)-1,3,3,3-tetrafluoro-2-(4-methylphenyl)prop-1-enoxy]acetamide
CID 46191524

Frequently Asked Questions

What is the IUPAC name of N-ethyl-N-(4-methylphenyl)-2-propoxyacetamide?
The IUPAC name of N-ethyl-N-(4-methylphenyl)-2-propoxyacetamide (CID 113227387) is N-ethyl-N-(4-methylphenyl)-2-propoxyacetamide.
What is the SMILES notation for N-ethyl-N-(4-methylphenyl)-2-propoxyacetamide?
The canonical SMILES for N-ethyl-N-(4-methylphenyl)-2-propoxyacetamide is CCCOCC(=O)N(CC)c1ccc(C)cc1.
What is the InChIKey of N-ethyl-N-(4-methylphenyl)-2-propoxyacetamide?
The InChIKey is APJRUEYOODROTE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21NO2/c1-4-10-17-11-14(16)15(5-2)13-8-6-12(3)7-9-13/h6-9H,4-5,10-11H2,1-3H3.
What are the key properties of N-ethyl-N-(4-methylphenyl)-2-propoxyacetamide?
N-ethyl-N-(4-methylphenyl)-2-propoxyacetamide has a molecular weight of 235.33 g/mol, XLogP of 2.77, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N-(4-methylphenyl)-2-propoxyacetamide is sourced from PubChem (CID 113227387), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).