furan-3-yl-[2-[(4-methoxyphenoxy)methyl]morpholin-4-yl]methanone

C17H19NO5 — CID 42861355

IUPACfuran-3-yl-[2-[(4-methoxyphenoxy)methyl]morpholin-4-yl]methanone
SMILESCOc1ccc(OCC2CN(C(=O)c3ccoc3)CCO2)cc1
InChIInChI=1S/C17H19NO5/c1-20-14-2-4-15(5-3-14)23-12-16-10-18(7-9-22-16)17(19)13-6-8-21-11-13/h2-6,8,11,16H,7,9-10,12H2,1H3
InChIKeyGDBZVKKBKAVRDI-UHFFFAOYSA-N
MW317.34 g/mol
LogP2.21
Rot. Bonds5

About furan-3-yl-[2-[(4-methoxyphenoxy)methyl]morpholin-4-yl]methanone

furan-3-yl-[2-[(4-methoxyphenoxy)methyl]morpholin-4-yl]methanone (PubChem CID 42861355) has the molecular formula C17H19NO5 and a molecular weight of 317.34 g/mol. Its IUPAC name is furan-3-yl-[2-[(4-methoxyphenoxy)methyl]morpholin-4-yl]methanone.

Molecular Properties

Compound Namefuran-3-yl-[2-[(4-methoxyphenoxy)methyl]morpholin-4-yl]methanone
PubChem CID42861355
Molecular FormulaC17H19NO5
Molecular Weight317.34 g/mol
Exact Mass317.13
IUPAC Namefuran-3-yl-[2-[(4-methoxyphenoxy)methyl]morpholin-4-yl]methanone
SMILESCOc1ccc(OCC2CN(C(=O)c3ccoc3)CCO2)cc1
InChIInChI=1S/C17H19NO5/c1-20-14-2-4-15(5-3-14)23-12-16-10-18(7-9-22-16)17(19)13-6-8-21-11-13/h2-6,8,11,16H,7,9-10,12H2,1H3
InChIKeyGDBZVKKBKAVRDI-UHFFFAOYSA-N
XLogP2.21
TPSA61.14 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms23
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500317.34
LogP ≤ 52.21
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of furan-3-yl-[2-[(4-methoxyphenoxy)methyl]morpholin-4-yl]methanone?
The IUPAC name of furan-3-yl-[2-[(4-methoxyphenoxy)methyl]morpholin-4-yl]methanone (CID 42861355) is furan-3-yl-[2-[(4-methoxyphenoxy)methyl]morpholin-4-yl]methanone.
What is the SMILES notation for furan-3-yl-[2-[(4-methoxyphenoxy)methyl]morpholin-4-yl]methanone?
The canonical SMILES for furan-3-yl-[2-[(4-methoxyphenoxy)methyl]morpholin-4-yl]methanone is COc1ccc(OCC2CN(C(=O)c3ccoc3)CCO2)cc1.
What is the InChIKey of furan-3-yl-[2-[(4-methoxyphenoxy)methyl]morpholin-4-yl]methanone?
The InChIKey is GDBZVKKBKAVRDI-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19NO5/c1-20-14-2-4-15(5-3-14)23-12-16-10-18(7-9-22-16)17(19)13-6-8-21-11-13/h2-6,8,11,16H,7,9-10,12H2,1H3.
What are the key properties of furan-3-yl-[2-[(4-methoxyphenoxy)methyl]morpholin-4-yl]methanone?
furan-3-yl-[2-[(4-methoxyphenoxy)methyl]morpholin-4-yl]methanone has a molecular weight of 317.34 g/mol, XLogP of 2.21, 5 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for furan-3-yl-[2-[(4-methoxyphenoxy)methyl]morpholin-4-yl]methanone is sourced from PubChem (CID 42861355), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).