2-[ethyl-[2-oxo-2-(oxolan-3-yl)ethyl]amino]-N-propan-2-ylacetamide

C13H24N2O3 — CID 113448780

IUPAC2-[ethyl-[2-oxo-2-(oxolan-3-yl)ethyl]amino]-N-propan-2-ylacetamide
SMILESCCN(CC(=O)NC(C)C)CC(=O)C1CCOC1
InChIInChI=1S/C13H24N2O3/c1-4-15(8-13(17)14-10(2)3)7-12(16)11-5-6-18-9-11/h10-11H,4-9H2,1-3H3,(H,14,17)
InChIKeyOLTBYXXCIIYQIO-UHFFFAOYSA-N
MW256.35 g/mol
LogP0.44
Rot. Bonds7

About 2-[ethyl-[2-oxo-2-(oxolan-3-yl)ethyl]amino]-N-propan-2-ylacetamide

2-[ethyl-[2-oxo-2-(oxolan-3-yl)ethyl]amino]-N-propan-2-ylacetamide (PubChem CID 113448780) has the molecular formula C13H24N2O3 and a molecular weight of 256.35 g/mol. Its IUPAC name is 2-[ethyl-[2-oxo-2-(oxolan-3-yl)ethyl]amino]-N-propan-2-ylacetamide.

Molecular Properties

Compound Name2-[ethyl-[2-oxo-2-(oxolan-3-yl)ethyl]amino]-N-propan-2-ylacetamide
PubChem CID113448780
Molecular FormulaC13H24N2O3
Molecular Weight256.35 g/mol
Exact Mass256.18
IUPAC Name2-[ethyl-[2-oxo-2-(oxolan-3-yl)ethyl]amino]-N-propan-2-ylacetamide
SMILESCCN(CC(=O)NC(C)C)CC(=O)C1CCOC1
InChIInChI=1S/C13H24N2O3/c1-4-15(8-13(17)14-10(2)3)7-12(16)11-5-6-18-9-11/h10-11H,4-9H2,1-3H3,(H,14,17)
InChIKeyOLTBYXXCIIYQIO-UHFFFAOYSA-N
XLogP0.44
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.35
LogP ≤ 50.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(dipropylamino)-1-(oxolan-3-yl)ethanone
CID 104749952
2-[ethyl(pyridin-4-ylmethyl)amino]-1-(oxolan-3-yl)ethanone
CID 113448768
N-[2-oxo-2-(propan-2-ylamino)ethyl]oxane-4-carboxamide
CID 51220547
3-methyl-1-(oxolan-3-yl)pentan-1-one
CID 65330399
2-[(2-cyclohexyl-2-oxoethyl)-ethylamino]-N-ethylacetamide
CID 104750581
2-[cyclobutylmethyl(methyl)amino]-1-(oxolan-3-yl)ethanone
CID 104750663
2-[2-(diethylamino)ethylsulfanyl]-1-(oxolan-3-yl)ethanone
CID 104752314
2-[ethyl-[2-oxo-2-(propan-2-ylamino)ethyl]amino]-N-(2-oxo-2-pyrrolidin-1-ylethyl)acetamide
CID 134038335
4-[2-oxo-2-(oxolan-3-yl)ethyl]-N-propan-2-ylmorpholine-3-carboxamide
CID 104751051
2-[methyl-(3-methylcyclohexyl)amino]-1-(oxolan-3-yl)ethanone
CID 104750164
4-methyl-1-(oxolan-3-yl)pentan-1-one
CID 63563225
2-[methyl-[2-(methylamino)ethyl]amino]-1-(oxolan-3-yl)ethanone
CID 104750828

Frequently Asked Questions

What is the IUPAC name of 2-[ethyl-[2-oxo-2-(oxolan-3-yl)ethyl]amino]-N-propan-2-ylacetamide?
The IUPAC name of 2-[ethyl-[2-oxo-2-(oxolan-3-yl)ethyl]amino]-N-propan-2-ylacetamide (CID 113448780) is 2-[ethyl-[2-oxo-2-(oxolan-3-yl)ethyl]amino]-N-propan-2-ylacetamide.
What is the SMILES notation for 2-[ethyl-[2-oxo-2-(oxolan-3-yl)ethyl]amino]-N-propan-2-ylacetamide?
The canonical SMILES for 2-[ethyl-[2-oxo-2-(oxolan-3-yl)ethyl]amino]-N-propan-2-ylacetamide is CCN(CC(=O)NC(C)C)CC(=O)C1CCOC1.
What is the InChIKey of 2-[ethyl-[2-oxo-2-(oxolan-3-yl)ethyl]amino]-N-propan-2-ylacetamide?
The InChIKey is OLTBYXXCIIYQIO-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N2O3/c1-4-15(8-13(17)14-10(2)3)7-12(16)11-5-6-18-9-11/h10-11H,4-9H2,1-3H3,(H,14,17).
What are the key properties of 2-[ethyl-[2-oxo-2-(oxolan-3-yl)ethyl]amino]-N-propan-2-ylacetamide?
2-[ethyl-[2-oxo-2-(oxolan-3-yl)ethyl]amino]-N-propan-2-ylacetamide has a molecular weight of 256.35 g/mol, XLogP of 0.44, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[ethyl-[2-oxo-2-(oxolan-3-yl)ethyl]amino]-N-propan-2-ylacetamide is sourced from PubChem (CID 113448780), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).