methyl 4-[2-(dipropylamino)-2-oxoethyl]morpholine-3-carboxylate

C14H26N2O4 — CID 115670583

IUPACmethyl 4-[2-(dipropylamino)-2-oxoethyl]morpholine-3-carboxylate
SMILESCCCN(CCC)C(=O)CN1CCOCC1C(=O)OC
InChIInChI=1S/C14H26N2O4/c1-4-6-15(7-5-2)13(17)10-16-8-9-20-11-12(16)14(18)19-3/h12H,4-11H2,1-3H3
InChIKeyZJEOUXDKXKWPAV-UHFFFAOYSA-N
MW286.37 g/mol
LogP0.51
Rot. Bonds7

About methyl 4-[2-(dipropylamino)-2-oxoethyl]morpholine-3-carboxylate

methyl 4-[2-(dipropylamino)-2-oxoethyl]morpholine-3-carboxylate (PubChem CID 115670583) has the molecular formula C14H26N2O4 and a molecular weight of 286.37 g/mol. Its IUPAC name is methyl 4-[2-(dipropylamino)-2-oxoethyl]morpholine-3-carboxylate.

Molecular Properties

Compound Namemethyl 4-[2-(dipropylamino)-2-oxoethyl]morpholine-3-carboxylate
PubChem CID115670583
Molecular FormulaC14H26N2O4
Molecular Weight286.37 g/mol
Exact Mass286.19
IUPAC Namemethyl 4-[2-(dipropylamino)-2-oxoethyl]morpholine-3-carboxylate
SMILESCCCN(CCC)C(=O)CN1CCOCC1C(=O)OC
InChIInChI=1S/C14H26N2O4/c1-4-6-15(7-5-2)13(17)10-16-8-9-20-11-12(16)14(18)19-3/h12H,4-11H2,1-3H3
InChIKeyZJEOUXDKXKWPAV-UHFFFAOYSA-N
XLogP0.51
TPSA59.08 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.37
LogP ≤ 50.51
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

methyl 4-[2-[methyl(propan-2-yl)amino]-2-oxoethyl]morpholine-3-carboxylate
CID 115752681
methyl 4-[2-[3-aminopropyl(methyl)amino]-2-oxoethyl]morpholine-3-carboxylate
CID 104774499
methyl 4-(2-butoxy-2-oxoethyl)morpholine-3-carboxylate
CID 113296435
methyl 4-[2-(butylamino)-2-oxoethyl]morpholine-3-carboxylate
CID 113247741
methyl 4-[2-(azetidin-1-yl)-2-oxoethyl]morpholine-3-carboxylate
CID 115670529
methyl 4-[2-oxo-2-(propylcarbamoylamino)ethyl]morpholine-3-carboxylate
CID 115670460
methyl 4-[3-(dimethylamino)-3-oxopropyl]morpholine-3-carboxylate
CID 115670530
methyl (3S)-4-[2-(cyclopropylamino)-2-oxoethyl]morpholine-3-carboxylate
CID 95786436
methyl 1-[2-(dipropylamino)-2-oxoethyl]-4-hydroxypyrrolidine-2-carboxylate
CID 115971555
methyl (3R)-4-[2-(cyclopropylamino)-2-oxoethyl]morpholine-3-carboxylate
CID 95786437
methyl 4-(oxolan-3-ylmethyl)morpholine-3-carboxylate
CID 115670570
methyl 4-(3-methylbut-2-enyl)morpholine-3-carboxylate
CID 115670618

Frequently Asked Questions

What is the IUPAC name of methyl 4-[2-(dipropylamino)-2-oxoethyl]morpholine-3-carboxylate?
The IUPAC name of methyl 4-[2-(dipropylamino)-2-oxoethyl]morpholine-3-carboxylate (CID 115670583) is methyl 4-[2-(dipropylamino)-2-oxoethyl]morpholine-3-carboxylate.
What is the SMILES notation for methyl 4-[2-(dipropylamino)-2-oxoethyl]morpholine-3-carboxylate?
The canonical SMILES for methyl 4-[2-(dipropylamino)-2-oxoethyl]morpholine-3-carboxylate is CCCN(CCC)C(=O)CN1CCOCC1C(=O)OC.
What is the InChIKey of methyl 4-[2-(dipropylamino)-2-oxoethyl]morpholine-3-carboxylate?
The InChIKey is ZJEOUXDKXKWPAV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N2O4/c1-4-6-15(7-5-2)13(17)10-16-8-9-20-11-12(16)14(18)19-3/h12H,4-11H2,1-3H3.
What are the key properties of methyl 4-[2-(dipropylamino)-2-oxoethyl]morpholine-3-carboxylate?
methyl 4-[2-(dipropylamino)-2-oxoethyl]morpholine-3-carboxylate has a molecular weight of 286.37 g/mol, XLogP of 0.51, 7 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 4-[2-(dipropylamino)-2-oxoethyl]morpholine-3-carboxylate is sourced from PubChem (CID 115670583), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).