2-[2-[ethyl(methyl)amino]ethoxy]-N-hexylacetamide

C13H28N2O2 — CID 170742438

IUPAC2-[2-[ethyl(methyl)amino]ethoxy]-N-hexylacetamide
SMILESCCCCCCNC(=O)COCCN(C)CC
InChIInChI=1S/C13H28N2O2/c1-4-6-7-8-9-14-13(16)12-17-11-10-15(3)5-2/h4-12H2,1-3H3,(H,14,16)
InChIKeyTXDDAANIWXCDQU-UHFFFAOYSA-N
MW244.38 g/mol
LogP1.65
Rot. Bonds11

About 2-[2-[ethyl(methyl)amino]ethoxy]-N-hexylacetamide

2-[2-[ethyl(methyl)amino]ethoxy]-N-hexylacetamide (PubChem CID 170742438) has the molecular formula C13H28N2O2 and a molecular weight of 244.38 g/mol. Its IUPAC name is 2-[2-[ethyl(methyl)amino]ethoxy]-N-hexylacetamide.

Molecular Properties

Compound Name2-[2-[ethyl(methyl)amino]ethoxy]-N-hexylacetamide
PubChem CID170742438
Molecular FormulaC13H28N2O2
Molecular Weight244.38 g/mol
Exact Mass244.22
IUPAC Name2-[2-[ethyl(methyl)amino]ethoxy]-N-hexylacetamide
SMILESCCCCCCNC(=O)COCCN(C)CC
InChIInChI=1S/C13H28N2O2/c1-4-6-7-8-9-14-13(16)12-17-11-10-15(3)5-2/h4-12H2,1-3H3,(H,14,16)
InChIKeyTXDDAANIWXCDQU-UHFFFAOYSA-N
XLogP1.65
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds11
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.38
LogP ≤ 51.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

2-[2-(dimethylamino)ethoxy]-N-hexylacetamide
CID 170742428
2-[2-[heptyl(methyl)amino]-2-oxoethoxy]-N-[4-[[2-[2-[heptyl(methyl)amino]-2-oxoethoxy]acetyl]amino]butyl]acetamide
CID 546525
2-[2-(2-aminoethoxy)ethoxy]-N-hexylacetamide
CID 144607638
2-[2-[ethyl(methyl)amino]ethoxy]-N,N-dihexylacetamide
CID 175987181
2-[2-(2-butoxyethoxy)ethoxy]-N-butylacetamide
CID 155190113
2-methoxy-N-nonylacetamide
CID 86922058
N-(5-iodopentyl)-2-propoxyacetamide
CID 107941565
2-[2-[2-[5-[[2-(2-butoxyethoxy)acetyl]amino]pentoxy]ethoxy]ethoxy]-N-methylacetamide
CID 134582817
N-[2-[2-[2-[2-[2-[2-(butylamino)-2-oxoethoxy]ethoxy]ethylamino]-2-oxoethoxy]ethoxy]ethyl]heptanamide
CID 89417865
3-[butyl(methyl)amino]-N-pentadecylpropanamide
CID 58040616
2-(2-aminoethoxy)-N-butylacetamide
CID 62343440
N-(11-oxododecyl)-2-propoxyacetamide
CID 20692360

Frequently Asked Questions

What is the IUPAC name of 2-[2-[ethyl(methyl)amino]ethoxy]-N-hexylacetamide?
The IUPAC name of 2-[2-[ethyl(methyl)amino]ethoxy]-N-hexylacetamide (CID 170742438) is 2-[2-[ethyl(methyl)amino]ethoxy]-N-hexylacetamide.
What is the SMILES notation for 2-[2-[ethyl(methyl)amino]ethoxy]-N-hexylacetamide?
The canonical SMILES for 2-[2-[ethyl(methyl)amino]ethoxy]-N-hexylacetamide is CCCCCCNC(=O)COCCN(C)CC.
What is the InChIKey of 2-[2-[ethyl(methyl)amino]ethoxy]-N-hexylacetamide?
The InChIKey is TXDDAANIWXCDQU-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H28N2O2/c1-4-6-7-8-9-14-13(16)12-17-11-10-15(3)5-2/h4-12H2,1-3H3,(H,14,16).
What are the key properties of 2-[2-[ethyl(methyl)amino]ethoxy]-N-hexylacetamide?
2-[2-[ethyl(methyl)amino]ethoxy]-N-hexylacetamide has a molecular weight of 244.38 g/mol, XLogP of 1.65, 11 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-[ethyl(methyl)amino]ethoxy]-N-hexylacetamide is sourced from PubChem (CID 170742438), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).