methyl 2-[4-[2-oxo-2-(pentan-3-ylamino)ethyl]morpholin-2-yl]acetate

C14H26N2O4 — CID 79822955

IUPACmethyl 2-[4-[2-oxo-2-(pentan-3-ylamino)ethyl]morpholin-2-yl]acetate
SMILESCCC(CC)NC(=O)CN1CCOC(CC(=O)OC)C1
InChIInChI=1S/C14H26N2O4/c1-4-11(5-2)15-13(17)10-16-6-7-20-12(9-16)8-14(18)19-3/h11-12H,4-10H2,1-3H3,(H,15,17)
InChIKeyQJUAYBALVQZSFD-UHFFFAOYSA-N
MW286.37 g/mol
LogP0.56
Rot. Bonds7

About methyl 2-[4-[2-oxo-2-(pentan-3-ylamino)ethyl]morpholin-2-yl]acetate

methyl 2-[4-[2-oxo-2-(pentan-3-ylamino)ethyl]morpholin-2-yl]acetate (PubChem CID 79822955) has the molecular formula C14H26N2O4 and a molecular weight of 286.37 g/mol. Its IUPAC name is methyl 2-[4-[2-oxo-2-(pentan-3-ylamino)ethyl]morpholin-2-yl]acetate.

Molecular Properties

Compound Namemethyl 2-[4-[2-oxo-2-(pentan-3-ylamino)ethyl]morpholin-2-yl]acetate
PubChem CID79822955
Molecular FormulaC14H26N2O4
Molecular Weight286.37 g/mol
Exact Mass286.19
IUPAC Namemethyl 2-[4-[2-oxo-2-(pentan-3-ylamino)ethyl]morpholin-2-yl]acetate
SMILESCCC(CC)NC(=O)CN1CCOC(CC(=O)OC)C1
InChIInChI=1S/C14H26N2O4/c1-4-11(5-2)15-13(17)10-16-6-7-20-12(9-16)8-14(18)19-3/h11-12H,4-10H2,1-3H3,(H,15,17)
InChIKeyQJUAYBALVQZSFD-UHFFFAOYSA-N
XLogP0.56
TPSA67.87 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.37
LogP ≤ 50.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze methyl 2-[4-[2-oxo-2-(pentan-3-ylamino)ethyl]morpholin-2-yl]acetate with MolForge

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Related Compounds

methyl 2-[4-[2-(butan-2-ylamino)-2-oxoethyl]morpholin-2-yl]acetate
CID 79822362
methyl 2-[4-[2-[(3-methyl-1,2-oxazol-5-yl)amino]-2-oxoethyl]morpholin-2-yl]acetate
CID 79827537
methyl 2-[4-[2-[cyclopropyl(ethyl)amino]-2-oxoethyl]morpholin-2-yl]acetate
CID 79822357
methyl 2-[4-(2-morpholin-4-ylethyl)morpholin-2-yl]acetate
CID 79822697
methyl 2-[4-(3-hydroxy-2-methylpropyl)morpholin-2-yl]acetate
CID 115873221
methyl 2-[4-(5-hydroxypentyl)morpholin-2-yl]acetate
CID 79823228
methyl 2-[4-(4-aminobutyl)morpholin-2-yl]acetate
CID 115533916
methyl 2-[4-(3-cyanopropyl)morpholin-2-yl]acetate
CID 79823047
methyl 2-[4-[2-(3-methylbutoxy)ethyl]morpholin-2-yl]acetate
CID 79823416
2-[(4-methylmorpholin-2-yl)methylamino]-N-pentan-3-ylacetamide
CID 78945150
methyl 2-[4-(2-bromobutanoyl)morpholin-2-yl]acetate
CID 115534261
ethyl 6-[2-(2-methoxy-2-oxoethyl)morpholin-4-yl]hexanoate
CID 79827518

Frequently Asked Questions

What is the IUPAC name of methyl 2-[4-[2-oxo-2-(pentan-3-ylamino)ethyl]morpholin-2-yl]acetate?
The IUPAC name of methyl 2-[4-[2-oxo-2-(pentan-3-ylamino)ethyl]morpholin-2-yl]acetate (CID 79822955) is methyl 2-[4-[2-oxo-2-(pentan-3-ylamino)ethyl]morpholin-2-yl]acetate.
What is the SMILES notation for methyl 2-[4-[2-oxo-2-(pentan-3-ylamino)ethyl]morpholin-2-yl]acetate?
The canonical SMILES for methyl 2-[4-[2-oxo-2-(pentan-3-ylamino)ethyl]morpholin-2-yl]acetate is CCC(CC)NC(=O)CN1CCOC(CC(=O)OC)C1.
What is the InChIKey of methyl 2-[4-[2-oxo-2-(pentan-3-ylamino)ethyl]morpholin-2-yl]acetate?
The InChIKey is QJUAYBALVQZSFD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N2O4/c1-4-11(5-2)15-13(17)10-16-6-7-20-12(9-16)8-14(18)19-3/h11-12H,4-10H2,1-3H3,(H,15,17).
What are the key properties of methyl 2-[4-[2-oxo-2-(pentan-3-ylamino)ethyl]morpholin-2-yl]acetate?
methyl 2-[4-[2-oxo-2-(pentan-3-ylamino)ethyl]morpholin-2-yl]acetate has a molecular weight of 286.37 g/mol, XLogP of 0.56, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 2-[4-[2-oxo-2-(pentan-3-ylamino)ethyl]morpholin-2-yl]acetate is sourced from PubChem (CID 79822955), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).