2-[ethyl(4-oxohexyl)amino]-N-methylacetamide

C11H22N2O2 — CID 106801333

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

About 2-[ethyl(4-oxohexyl)amino]-N-methylacetamide

2-[ethyl(4-oxohexyl)amino]-N-methylacetamide (PubChem CID 106801333) has the molecular formula C11H22N2O2 and a molecular weight of 214.31 g/mol. Its IUPAC name is 2-[ethyl(4-oxohexyl)amino]-N-methylacetamide.

Molecular Properties

Compound Name2-[ethyl(4-oxohexyl)amino]-N-methylacetamide
PubChem CID106801333
Molecular FormulaC11H22N2O2
Molecular Weight214.31 g/mol
Exact Mass214.17
IUPAC Name2-[ethyl(4-oxohexyl)amino]-N-methylacetamide
SMILESCCC(=O)CCCN(CC)CC(=O)NC
InChIInChI=1S/C11H22N2O2/c1-4-10(14)7-6-8-13(5-2)9-11(15)12-3/h4-9H2,1-3H3,(H,12,15)
InChIKeyOKLQCZXZEQWJSH-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

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Related Compounds

N-methyl-2-[4-oxohexyl(propyl)amino]acetamide
CID 106801369
N-ethyl-2-[ethyl(4-oxohexyl)amino]acetamide
CID 106801389
2-[(4-amino-4-sulfanylidenebutyl)-ethylamino]-N-methylacetamide
CID 61450914
2-[ethyl(5-oxohexyl)amino]-N-methylacetamide
CID 62052639
6-[ethyl-(2-hydroxy-2-methylpropyl)amino]hexan-3-one
CID 106801517
hydrazinyl 3-[ethyl-[2-(methylamino)-2-oxoethyl]amino]propanoate
CID 66337491
2-[butyl(6-sulfanylhexyl)amino]-N-methylacetamide
CID 158713217
6-[ethyl(methyl)amino]hexan-3-one
CID 106801171
2-[2-[2-[bis(2-oxobutyl)amino]ethyl-(2-oxoethyl)amino]ethyl-(2-oxobutyl)amino]-N-methylacetamide;ethane
CID 145053798
2-ethyl-4-[ethyl-[2-(methylamino)-2-oxoethyl]amino]but-2-enoic acid
CID 77100771
2-[ethyl-(2-hydroxy-2-methylpropyl)amino]-N-methylacetamide
CID 79390515
N-methyl-2-[2-oxobutyl-[2-oxo-2-(6-oxoheptylamino)ethyl]amino]acetamide
CID 160754701

Frequently Asked Questions

What is the IUPAC name of 2-[ethyl(4-oxohexyl)amino]-N-methylacetamide?
The IUPAC name of 2-[ethyl(4-oxohexyl)amino]-N-methylacetamide (CID 106801333) is 2-[ethyl(4-oxohexyl)amino]-N-methylacetamide.
What is the SMILES notation for 2-[ethyl(4-oxohexyl)amino]-N-methylacetamide?
The canonical SMILES for 2-[ethyl(4-oxohexyl)amino]-N-methylacetamide is CCC(=O)CCCN(CC)CC(=O)NC.
What is the InChIKey of 2-[ethyl(4-oxohexyl)amino]-N-methylacetamide?
The InChIKey is OKLQCZXZEQWJSH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2O2/c1-4-10(14)7-6-8-13(5-2)9-11(15)12-3/h4-9H2,1-3H3,(H,12,15).
What are the key properties of 2-[ethyl(4-oxohexyl)amino]-N-methylacetamide?
2-[ethyl(4-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(4-oxohexyl)amino]-N-methylacetamide is sourced from PubChem (CID 106801333), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).