ethane;2-[(6-ethoxyoxan-2-yl)methoxy]-N-propylacetamide

C15H31NO4 — CID 143928045

IUPACethane;2-[(6-ethoxyoxan-2-yl)methoxy]-N-propylacetamide
SMILESCC.CCCNC(=O)COCC1CCCC(OCC)O1
InChIInChI=1S/C13H25NO4.C2H6/c1-3-8-14-12(15)10-16-9-11-6-5-7-13(18-11)17-4-2;1-2/h11,13H,3-10H2,1-2H3,(H,14,15);1-2H3
InChIKeyFGGCYUXTAJTNPZ-UHFFFAOYSA-N
MW289.42 g/mol
LogP2.49
Rot. Bonds8

About ethane;2-[(6-ethoxyoxan-2-yl)methoxy]-N-propylacetamide

ethane;2-[(6-ethoxyoxan-2-yl)methoxy]-N-propylacetamide (PubChem CID 143928045) has the molecular formula C15H31NO4 and a molecular weight of 289.42 g/mol. Its IUPAC name is ethane;2-[(6-ethoxyoxan-2-yl)methoxy]-N-propylacetamide.

Molecular Properties

Compound Nameethane;2-[(6-ethoxyoxan-2-yl)methoxy]-N-propylacetamide
PubChem CID143928045
Molecular FormulaC15H31NO4
Molecular Weight289.42 g/mol
Exact Mass289.23
IUPAC Nameethane;2-[(6-ethoxyoxan-2-yl)methoxy]-N-propylacetamide
SMILESCC.CCCNC(=O)COCC1CCCC(OCC)O1
InChIInChI=1S/C13H25NO4.C2H6/c1-3-8-14-12(15)10-16-9-11-6-5-7-13(18-11)17-4-2;1-2/h11,13H,3-10H2,1-2H3,(H,14,15);1-2H3
InChIKeyFGGCYUXTAJTNPZ-UHFFFAOYSA-N
XLogP2.49
TPSA56.79 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.42
LogP ≤ 52.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze ethane;2-[(6-ethoxyoxan-2-yl)methoxy]-N-propylacetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-[[6-(2-methylpropoxy)oxan-2-yl]methoxy]butan-2-one
CID 146621932
2-(bromomethoxy)-N-propylacetamide
CID 140767535
N-(2-cyclobutylethyl)-2-propoxyacetamide
CID 103747320
tert-butyl-[[(2S)-6-ethoxyoxan-2-yl]methoxy]-dimethylsilane
CID 139257646
3-[[2-(oxolan-2-ylmethoxy)acetyl]amino]propanoic acid
CID 115729941
2-(2-propoxyethoxy)-N-propylacetamide
CID 149463198
2-[(6-aminooxan-2-yl)methoxy]acetamide
CID 123485245
2-(6-methylpiperidin-3-yl)oxy-N-propylacetamide
CID 62073916
N-(2-cyclohexyloxyethyl)-2-ethoxyacetamide
CID 61217692
N-[2-oxo-2-(propylamino)ethyl]cyclobutanecarboxamide
CID 112990469
2-[2-(methylamino)cyclohexyl]oxy-N-propylacetamide
CID 102633360
N-(3-cyclohexyloxypropyl)-2-ethoxyacetamide
CID 60668714

Frequently Asked Questions

What is the IUPAC name of ethane;2-[(6-ethoxyoxan-2-yl)methoxy]-N-propylacetamide?
The IUPAC name of ethane;2-[(6-ethoxyoxan-2-yl)methoxy]-N-propylacetamide (CID 143928045) is ethane;2-[(6-ethoxyoxan-2-yl)methoxy]-N-propylacetamide.
What is the SMILES notation for ethane;2-[(6-ethoxyoxan-2-yl)methoxy]-N-propylacetamide?
The canonical SMILES for ethane;2-[(6-ethoxyoxan-2-yl)methoxy]-N-propylacetamide is CC.CCCNC(=O)COCC1CCCC(OCC)O1.
What is the InChIKey of ethane;2-[(6-ethoxyoxan-2-yl)methoxy]-N-propylacetamide?
The InChIKey is FGGCYUXTAJTNPZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H25NO4.C2H6/c1-3-8-14-12(15)10-16-9-11-6-5-7-13(18-11)17-4-2;1-2/h11,13H,3-10H2,1-2H3,(H,14,15);1-2H3.
What are the key properties of ethane;2-[(6-ethoxyoxan-2-yl)methoxy]-N-propylacetamide?
ethane;2-[(6-ethoxyoxan-2-yl)methoxy]-N-propylacetamide has a molecular weight of 289.42 g/mol, XLogP of 2.49, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;2-[(6-ethoxyoxan-2-yl)methoxy]-N-propylacetamide is sourced from PubChem (CID 143928045), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).