2-[ethyl(5-oxohexyl)amino]-N-methylacetamide

C11H22N2O2 — CID 62052639

IUPAC2-[ethyl(5-oxohexyl)amino]-N-methylacetamide
SMILESCCN(CCCCC(C)=O)CC(=O)NC
InChIInChI=1S/C11H22N2O2/c1-4-13(9-11(15)12-3)8-6-5-7-10(2)14/h4-9H2,1-3H3,(H,12,15)
InChIKeyMZWZCDUKWSGEMJ-UHFFFAOYSA-N
MW214.31 g/mol
LogP0.81
Rot. Bonds8

About 2-[ethyl(5-oxohexyl)amino]-N-methylacetamide

2-[ethyl(5-oxohexyl)amino]-N-methylacetamide (PubChem CID 62052639) has the molecular formula C11H22N2O2 and a molecular weight of 214.31 g/mol. Its IUPAC name is 2-[ethyl(5-oxohexyl)amino]-N-methylacetamide.

Molecular Properties

Compound Name2-[ethyl(5-oxohexyl)amino]-N-methylacetamide
PubChem CID62052639
Molecular FormulaC11H22N2O2
Molecular Weight214.31 g/mol
Exact Mass214.17
IUPAC Name2-[ethyl(5-oxohexyl)amino]-N-methylacetamide
SMILESCCN(CCCCC(C)=O)CC(=O)NC
InChIInChI=1S/C11H22N2O2/c1-4-13(9-11(15)12-3)8-6-5-7-10(2)14/h4-9H2,1-3H3,(H,12,15)
InChIKeyMZWZCDUKWSGEMJ-UHFFFAOYSA-N
XLogP0.81
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.31
LogP ≤ 50.81
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-[ethyl(4-oxohexyl)amino]-N-methylacetamide
CID 106801333
2-[(4-amino-4-sulfanylidenebutyl)-ethylamino]-N-methylacetamide
CID 61450914
6-[ethyl(propyl)amino]hexan-2-one
CID 43792940
N-methyl-2-[3-oxobutyl(propyl)amino]acetamide
CID 62036736
7-[ethyl(7-hydroxyheptyl)amino]heptan-2-one
CID 171562657
N-methyl-2-[2-oxobutyl-[2-oxo-2-(6-oxoheptylamino)ethyl]amino]acetamide
CID 160754701
N-methyl-2-[[2-(methylamino)-2-oxoethyl]-(2-oxopropyl)amino]acetamide
CID 163933463
5-[ethyl(propyl)amino]pentan-2-one
CID 43792941
hydrazinyl 3-[ethyl-[2-(methylamino)-2-oxoethyl]amino]propanoate
CID 66337491
2-[(2-amino-2-oxoethyl)-(5-oxohexyl)amino]acetamide
CID 62921718
1-[ethyl(nonyl)amino]propan-2-one
CID 156818313
2-[butyl(6-sulfanylhexyl)amino]-N-methylacetamide
CID 158713217

Frequently Asked Questions

What is the IUPAC name of 2-[ethyl(5-oxohexyl)amino]-N-methylacetamide?
The IUPAC name of 2-[ethyl(5-oxohexyl)amino]-N-methylacetamide (CID 62052639) is 2-[ethyl(5-oxohexyl)amino]-N-methylacetamide.
What is the SMILES notation for 2-[ethyl(5-oxohexyl)amino]-N-methylacetamide?
The canonical SMILES for 2-[ethyl(5-oxohexyl)amino]-N-methylacetamide is CCN(CCCCC(C)=O)CC(=O)NC.
What is the InChIKey of 2-[ethyl(5-oxohexyl)amino]-N-methylacetamide?
The InChIKey is MZWZCDUKWSGEMJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2O2/c1-4-13(9-11(15)12-3)8-6-5-7-10(2)14/h4-9H2,1-3H3,(H,12,15).
What are the key properties of 2-[ethyl(5-oxohexyl)amino]-N-methylacetamide?
2-[ethyl(5-oxohexyl)amino]-N-methylacetamide has a molecular weight of 214.31 g/mol, XLogP of 0.81, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[ethyl(5-oxohexyl)amino]-N-methylacetamide is sourced from PubChem (CID 62052639), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).