N-ethyl-N-methyl-3-propoxypropanamide

C9H19NO2 — CID 87235290

IUPACN-ethyl-N-methyl-3-propoxypropanamide
SMILESCCCOCCC(=O)N(C)CC
InChIInChI=1S/C9H19NO2/c1-4-7-12-8-6-9(11)10(3)5-2/h4-8H2,1-3H3
InChIKeyWJTDATIMGLGNQG-UHFFFAOYSA-N
MW173.26 g/mol
LogP1.28
Rot. Bonds6

About N-ethyl-N-methyl-3-propoxypropanamide

N-ethyl-N-methyl-3-propoxypropanamide (PubChem CID 87235290) has the molecular formula C9H19NO2 and a molecular weight of 173.26 g/mol. Its IUPAC name is N-ethyl-N-methyl-3-propoxypropanamide.

Molecular Properties

Compound NameN-ethyl-N-methyl-3-propoxypropanamide
PubChem CID87235290
Molecular FormulaC9H19NO2
Molecular Weight173.26 g/mol
Exact Mass173.14
IUPAC NameN-ethyl-N-methyl-3-propoxypropanamide
SMILESCCCOCCC(=O)N(C)CC
InChIInChI=1S/C9H19NO2/c1-4-7-12-8-6-9(11)10(3)5-2/h4-8H2,1-3H3
InChIKeyWJTDATIMGLGNQG-UHFFFAOYSA-N
XLogP1.28
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500173.26
LogP ≤ 51.28
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

N-ethyl-3-hexoxy-N-methylpropanamide
CID 87235746
3-(2-aminoethoxy)-N-ethyl-N-methylpropanamide
CID 162436526
N-(cyanomethyl)-N-methyl-3-propoxypropanamide
CID 62716829
N-(2-aminoethyl)-N-ethyl-3-propoxypropanamide
CID 62688574
3-butan-2-yloxy-N-ethyl-N-methylpropanamide
CID 87235407
3-[2-[2-[2-[3-(dimethylamino)-3-oxopropoxy]ethoxy]ethoxy]ethoxy]-N,N-dimethylpropanamide
CID 71364213
3-[2-[2-[2-[2-[ethyl(methyl)amino]ethoxy]ethoxy]ethoxy]ethoxy]-N-[3-[ethyl(methyl)amino]propyl]-N-methylpropanamide
CID 167270871
(Z)-4-oxo-6-propoxyhex-2-enoic acid
CID 134452151
N-(4-hydroxyphenyl)-N-methyl-3-propoxypropanamide
CID 62716161
2-(2-ethoxyethoxy)-N-ethyl-N-methylacetamide
CID 143737672
N,N-dimethyl-3-octadecoxypropanamide
CID 155355336
N-(3-aminopropyl)-N-(2-methoxyethyl)-3-propoxypropanamide
CID 63287771

Frequently Asked Questions

What is the IUPAC name of N-ethyl-N-methyl-3-propoxypropanamide?
The IUPAC name of N-ethyl-N-methyl-3-propoxypropanamide (CID 87235290) is N-ethyl-N-methyl-3-propoxypropanamide.
What is the SMILES notation for N-ethyl-N-methyl-3-propoxypropanamide?
The canonical SMILES for N-ethyl-N-methyl-3-propoxypropanamide is CCCOCCC(=O)N(C)CC.
What is the InChIKey of N-ethyl-N-methyl-3-propoxypropanamide?
The InChIKey is WJTDATIMGLGNQG-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19NO2/c1-4-7-12-8-6-9(11)10(3)5-2/h4-8H2,1-3H3.
What are the key properties of N-ethyl-N-methyl-3-propoxypropanamide?
N-ethyl-N-methyl-3-propoxypropanamide has a molecular weight of 173.26 g/mol, XLogP of 1.28, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N-methyl-3-propoxypropanamide is sourced from PubChem (CID 87235290), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).