(3,5-dimethylfuran-2-yl)-[6-(methoxymethyl)-2,2-dimethylmorpholin-4-yl]methanone

C15H23NO4 — CID 128978502

IUPAC(3,5-dimethylfuran-2-yl)-[6-(methoxymethyl)-2,2-dimethylmorpholin-4-yl]methanone
SMILESCOCC1CN(C(=O)c2oc(C)cc2C)CC(C)(C)O1
InChIInChI=1S/C15H23NO4/c1-10-6-11(2)19-13(10)14(17)16-7-12(8-18-5)20-15(3,4)9-16/h6,12H,7-9H2,1-5H3
InChIKeyFPQFCJUKEQDNMH-UHFFFAOYSA-N
MW281.35 g/mol
LogP2.16
Rot. Bonds3

About (3,5-dimethylfuran-2-yl)-[6-(methoxymethyl)-2,2-dimethylmorpholin-4-yl]methanone

(3,5-dimethylfuran-2-yl)-[6-(methoxymethyl)-2,2-dimethylmorpholin-4-yl]methanone (PubChem CID 128978502) has the molecular formula C15H23NO4 and a molecular weight of 281.35 g/mol. Its IUPAC name is (3,5-dimethylfuran-2-yl)-[6-(methoxymethyl)-2,2-dimethylmorpholin-4-yl]methanone.

Molecular Properties

Compound Name(3,5-dimethylfuran-2-yl)-[6-(methoxymethyl)-2,2-dimethylmorpholin-4-yl]methanone
PubChem CID128978502
Molecular FormulaC15H23NO4
Molecular Weight281.35 g/mol
Exact Mass281.16
IUPAC Name(3,5-dimethylfuran-2-yl)-[6-(methoxymethyl)-2,2-dimethylmorpholin-4-yl]methanone
SMILESCOCC1CN(C(=O)c2oc(C)cc2C)CC(C)(C)O1
InChIInChI=1S/C15H23NO4/c1-10-6-11(2)19-13(10)14(17)16-7-12(8-18-5)20-15(3,4)9-16/h6,12H,7-9H2,1-5H3
InChIKeyFPQFCJUKEQDNMH-UHFFFAOYSA-N
XLogP2.16
TPSA51.91 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.35
LogP ≤ 52.16
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

[5-(hydroxymethyl)-3-methylfuran-2-yl]-[6-(methoxymethyl)-2,2-dimethylmorpholin-4-yl]methanone
CID 128989906
[(6R)-6-(methoxymethyl)-2,2-dimethylmorpholin-4-yl]-(5-methylfuran-2-yl)methanone
CID 129484541
[(6S)-6-(methoxymethyl)-2,2-dimethylmorpholin-4-yl]-(2-methyl-1H-pyrrol-3-yl)methanone
CID 129484746
5-[6-(methoxymethyl)-2,2-dimethylmorpholine-4-carbonyl]-4-methyl-1H-pyridin-2-one
CID 128978782
[6-(methoxymethyl)-2,2-dimethylmorpholin-4-yl]-[4-(5-methylpyrazol-1-yl)phenyl]methanone
CID 128978537
furan-3-yl-[(6R)-6-(methoxymethyl)-2,2-dimethylmorpholin-4-yl]methanone
CID 129485837
[(6R)-6-(methoxymethyl)-2,2-dimethylmorpholin-4-yl]-[4-(methoxymethyl)phenyl]methanone
CID 129485960
[6-(methoxymethyl)-2,2-dimethylmorpholin-4-yl]-(3-methylpyridazin-4-yl)methanone
CID 154744784
(5-hydroxy-3-pyridinyl)-[6-(methoxymethyl)-2,2-dimethylmorpholin-4-yl]methanone
CID 128978801
[(6R)-6-(methoxymethyl)-2,2-dimethylmorpholin-4-yl]-(6-methyl-3-pyridinyl)methanone
CID 129485933
[(6R)-6-(methoxymethyl)-2,2-dimethylmorpholin-4-yl]-(2-phenylpyrazol-3-yl)methanone
CID 129484804
[(6R)-6-(methoxymethyl)-2,2-dimethylmorpholin-4-yl]-(2-methyl-1,3-benzoxazol-5-yl)methanone
CID 129484739

Frequently Asked Questions

What is the IUPAC name of (3,5-dimethylfuran-2-yl)-[6-(methoxymethyl)-2,2-dimethylmorpholin-4-yl]methanone?
The IUPAC name of (3,5-dimethylfuran-2-yl)-[6-(methoxymethyl)-2,2-dimethylmorpholin-4-yl]methanone (CID 128978502) is (3,5-dimethylfuran-2-yl)-[6-(methoxymethyl)-2,2-dimethylmorpholin-4-yl]methanone.
What is the SMILES notation for (3,5-dimethylfuran-2-yl)-[6-(methoxymethyl)-2,2-dimethylmorpholin-4-yl]methanone?
The canonical SMILES for (3,5-dimethylfuran-2-yl)-[6-(methoxymethyl)-2,2-dimethylmorpholin-4-yl]methanone is COCC1CN(C(=O)c2oc(C)cc2C)CC(C)(C)O1.
What is the InChIKey of (3,5-dimethylfuran-2-yl)-[6-(methoxymethyl)-2,2-dimethylmorpholin-4-yl]methanone?
The InChIKey is FPQFCJUKEQDNMH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23NO4/c1-10-6-11(2)19-13(10)14(17)16-7-12(8-18-5)20-15(3,4)9-16/h6,12H,7-9H2,1-5H3.
What are the key properties of (3,5-dimethylfuran-2-yl)-[6-(methoxymethyl)-2,2-dimethylmorpholin-4-yl]methanone?
(3,5-dimethylfuran-2-yl)-[6-(methoxymethyl)-2,2-dimethylmorpholin-4-yl]methanone has a molecular weight of 281.35 g/mol, XLogP of 2.16, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (3,5-dimethylfuran-2-yl)-[6-(methoxymethyl)-2,2-dimethylmorpholin-4-yl]methanone is sourced from PubChem (CID 128978502), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).