methyl 5-[[2-(2-methoxy-2-oxoethyl)morpholin-4-yl]methyl]furan-2-carboxylate

C14H19NO6 — CID 79827347

IUPACmethyl 5-[[2-(2-methoxy-2-oxoethyl)morpholin-4-yl]methyl]furan-2-carboxylate
SMILESCOC(=O)CC1CN(Cc2ccc(C(=O)OC)o2)CCO1
InChIInChI=1S/C14H19NO6/c1-18-13(16)7-11-9-15(5-6-20-11)8-10-3-4-12(21-10)14(17)19-2/h3-4,11H,5-9H2,1-2H3
InChIKeyOPQPMNPFNBNEEF-UHFFFAOYSA-N
MW297.31 g/mol
LogP0.83
Rot. Bonds5

About methyl 5-[[2-(2-methoxy-2-oxoethyl)morpholin-4-yl]methyl]furan-2-carboxylate

methyl 5-[[2-(2-methoxy-2-oxoethyl)morpholin-4-yl]methyl]furan-2-carboxylate (PubChem CID 79827347) has the molecular formula C14H19NO6 and a molecular weight of 297.31 g/mol. Its IUPAC name is methyl 5-[[2-(2-methoxy-2-oxoethyl)morpholin-4-yl]methyl]furan-2-carboxylate.

Molecular Properties

Compound Namemethyl 5-[[2-(2-methoxy-2-oxoethyl)morpholin-4-yl]methyl]furan-2-carboxylate
PubChem CID79827347
Molecular FormulaC14H19NO6
Molecular Weight297.31 g/mol
Exact Mass297.12
IUPAC Namemethyl 5-[[2-(2-methoxy-2-oxoethyl)morpholin-4-yl]methyl]furan-2-carboxylate
SMILESCOC(=O)CC1CN(Cc2ccc(C(=O)OC)o2)CCO1
InChIInChI=1S/C14H19NO6/c1-18-13(16)7-11-9-15(5-6-20-11)8-10-3-4-12(21-10)14(17)19-2/h3-4,11H,5-9H2,1-2H3
InChIKeyOPQPMNPFNBNEEF-UHFFFAOYSA-N
XLogP0.83
TPSA78.21 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.31
LogP ≤ 50.83
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

Analyze methyl 5-[[2-(2-methoxy-2-oxoethyl)morpholin-4-yl]methyl]furan-2-carboxylate with MolForge

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Related Compounds

methyl 2-[(2R)-4-[[5-[(1S,2R)-2-methylcyclopropyl]furan-2-yl]methyl]morpholin-2-yl]acetate
CID 97159681
methyl 5-[[4-[(5-methoxycarbonylfuran-2-yl)methyl]piperazin-1-yl]methyl]furan-2-carboxylate
CID 652979
methyl 2-[4-[(3-bromophenyl)methyl]morpholin-2-yl]acetate
CID 79822600
methyl 2-[4-[(3-methylphenyl)methyl]morpholin-2-yl]acetate
CID 79822269
methyl 2-[4-(1,2-oxazol-4-ylmethyl)morpholin-2-yl]acetate
CID 115537759
methyl 2-[4-[[4-(3,5-dimethylpyrazol-1-yl)phenyl]methyl]morpholin-2-yl]acetate
CID 71861742
methyl 2-[4-[(2,5-dimethylphenyl)methyl]morpholin-2-yl]acetate
CID 79822519
methyl 5-[[3-(methylaminomethyl)piperidin-1-yl]methyl]furan-2-carboxylate
CID 61204990
methyl 5-[(4-amino-3-methylpiperidin-1-yl)methyl]furan-2-carboxylate
CID 79868617
methyl 2-[(2R)-4-[(2-chlorophenyl)methyl]morpholin-2-yl]acetate
CID 97062552
methyl 2-[4-[[4-(aminomethyl)-2-fluorophenyl]methyl]morpholin-2-yl]acetate
CID 115533910
methyl 2-[4-[(3-bromo-2,6-difluorophenyl)methyl]morpholin-2-yl]acetate
CID 106270408

Frequently Asked Questions

What is the IUPAC name of methyl 5-[[2-(2-methoxy-2-oxoethyl)morpholin-4-yl]methyl]furan-2-carboxylate?
The IUPAC name of methyl 5-[[2-(2-methoxy-2-oxoethyl)morpholin-4-yl]methyl]furan-2-carboxylate (CID 79827347) is methyl 5-[[2-(2-methoxy-2-oxoethyl)morpholin-4-yl]methyl]furan-2-carboxylate.
What is the SMILES notation for methyl 5-[[2-(2-methoxy-2-oxoethyl)morpholin-4-yl]methyl]furan-2-carboxylate?
The canonical SMILES for methyl 5-[[2-(2-methoxy-2-oxoethyl)morpholin-4-yl]methyl]furan-2-carboxylate is COC(=O)CC1CN(Cc2ccc(C(=O)OC)o2)CCO1.
What is the InChIKey of methyl 5-[[2-(2-methoxy-2-oxoethyl)morpholin-4-yl]methyl]furan-2-carboxylate?
The InChIKey is OPQPMNPFNBNEEF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19NO6/c1-18-13(16)7-11-9-15(5-6-20-11)8-10-3-4-12(21-10)14(17)19-2/h3-4,11H,5-9H2,1-2H3.
What are the key properties of methyl 5-[[2-(2-methoxy-2-oxoethyl)morpholin-4-yl]methyl]furan-2-carboxylate?
methyl 5-[[2-(2-methoxy-2-oxoethyl)morpholin-4-yl]methyl]furan-2-carboxylate has a molecular weight of 297.31 g/mol, XLogP of 0.83, 5 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 5-[[2-(2-methoxy-2-oxoethyl)morpholin-4-yl]methyl]furan-2-carboxylate is sourced from PubChem (CID 79827347), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).